cometadata/datacite-titles-descriptions-related-identifiers huggingface dataset:
DOI: 10.5517/ccdc.csd.cc2blg1g
title: CCDC 2162685: Experimental Crystal Structure Determination

description: Related Article: Joel Häfliger, Olga O. Sokolova, Madina Lenz, Constantin G. Daniliuc, Ryan Gilmour|2022|Angew.Chem.,Int.Ed.|61|e202205277|doi:10.1002/anie.202205277
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/ccdc.csd.cc2blg2h
title: CCDC 2162686: Experimental Crystal Structure Determination

description: Related Article: Joel Häfliger, Olga O. Sokolova, Madina Lenz, Constantin G. Daniliuc, Ryan Gilmour|2022|Angew.Chem.,Int.Ed.|61|e202205277|doi:10.1002/anie.202205277
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/ccdc.csd.cc2blk5p
title: CCDC 2162782: Experimental Crystal Structure Determination

description: Related Article: Sheng-Qun Su, Shu-Qi Wu, Yu-Bo Huang, Wen-Huang Xu, Kai-Ge Gao, Atsushi Okazawa, Hajime Okajima, Akira Sakamoto, Shinji Kanegawa, Osamu Sato|2022|Angew.Chem.,Int.Ed.|61|e202208771|doi:10.1002/anie.202208771
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/ccdc.csd.cc2blk6q
title: CCDC 2162783: Experimental Crystal Structure Determination

description: Related Article: Sheng-Qun Su, Shu-Qi Wu, Yu-Bo Huang, Wen-Huang Xu, Kai-Ge Gao, Atsushi Okazawa, Hajime Okajima, Akira Sakamoto, Shinji Kanegawa, Osamu Sato|2022|Angew.Chem.,Int.Ed.|61|e202208771|doi:10.1002/anie.202208771
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/ccdc.csd.cc2blk7r
title: CCDC 2162784: Experimental Crystal Structure Determination

description: Related Article: Sheng-Qun Su, Shu-Qi Wu, Yu-Bo Huang, Wen-Huang Xu, Kai-Ge Gao, Atsushi Okazawa, Hajime Okajima, Akira Sakamoto, Shinji Kanegawa, Osamu Sato|2022|Angew.Chem.,Int.Ed.|61|e202208771|doi:10.1002/anie.202208771
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/ccdc.csd.cc2blk8s
title: CCDC 2162785: Experimental Crystal Structure Determination

description: Related Article: Sheng-Qun Su, Shu-Qi Wu, Yu-Bo Huang, Wen-Huang Xu, Kai-Ge Gao, Atsushi Okazawa, Hajime Okajima, Akira Sakamoto, Shinji Kanegawa, Osamu Sato|2022|Angew.Chem.,Int.Ed.|61|e202208771|doi:10.1002/anie.202208771
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/ccdc.csd.cc2blk9t
title: CCDC 2162786: Experimental Crystal Structure Determination

description: Related Article: Sheng-Qun Su, Shu-Qi Wu, Yu-Bo Huang, Wen-Huang Xu, Kai-Ge Gao, Atsushi Okazawa, Hajime Okajima, Akira Sakamoto, Shinji Kanegawa, Osamu Sato|2022|Angew.Chem.,Int.Ed.|61|e202208771|doi:10.1002/anie.202208771
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/ccdc.csd.cc2blkbv
title: CCDC 2162787: Experimental Crystal Structure Determination

description: Related Article: Sheng-Qun Su, Shu-Qi Wu, Yu-Bo Huang, Wen-Huang Xu, Kai-Ge Gao, Atsushi Okazawa, Hajime Okajima, Akira Sakamoto, Shinji Kanegawa, Osamu Sato|2022|Angew.Chem.,Int.Ed.|61|e202208771|doi:10.1002/anie.202208771
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/ccdc.csd.cc2blkcw
title: CCDC 2162788: Experimental Crystal Structure Determination

description: Related Article: Sheng-Qun Su, Shu-Qi Wu, Yu-Bo Huang, Wen-Huang Xu, Kai-Ge Gao, Atsushi Okazawa, Hajime Okajima, Akira Sakamoto, Shinji Kanegawa, Osamu Sato|2022|Angew.Chem.,Int.Ed.|61|e202208771|doi:10.1002/anie.202208771
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/ccdc.csd.cc2blkdx
title: CCDC 2162789: Experimental Crystal Structure Determination

description: Related Article: Sheng-Qun Su, Shu-Qi Wu, Yu-Bo Huang, Wen-Huang Xu, Kai-Ge Gao, Atsushi Okazawa, Hajime Okajima, Akira Sakamoto, Shinji Kanegawa, Osamu Sato|2022|Angew.Chem.,Int.Ed.|61|e202208771|doi:10.1002/anie.202208771
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/ccdc.csd.cc2blkfy
title: CCDC 2162790: Experimental Crystal Structure Determination

description: Related Article: Sheng-Qun Su, Shu-Qi Wu, Yu-Bo Huang, Wen-Huang Xu, Kai-Ge Gao, Atsushi Okazawa, Hajime Okajima, Akira Sakamoto, Shinji Kanegawa, Osamu Sato|2022|Angew.Chem.,Int.Ed.|61|e202208771|doi:10.1002/anie.202208771
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/ccdc.csd.cc29x5l0
title: CCDC 2142242: Experimental Crystal Structure Determination

description: Related Article: xiuhong pan|2022|CSD Communication|||
description: Related Article: Xiuhong Pan, Anyi Zheng, Xu Yu, Qi Di, Liang Li, Pengfei Duan, Kaiqi Ye, Panče Naumov, Hongyu Zhang|2022|Angew.Chem.,Int.Ed.|61|e202203938|doi:10.1002/anie.202203938
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/ccdc.csd.cc2blkm4
title: CCDC 2162796: Experimental Crystal Structure Determination

description: Related Article: Meng Chen, Jingkai Xu, Deshi Zhao, Fangxiang Sun, Songlin Tian, Deshuang Tu, Changsheng Lu, Hong Yan|2022|Angew.Chem.,Int.Ed.|61|e202205672|doi:10.1002/anie.202205672
description: Related Article: Jingkai Xu, Meng Chen, Deshi Zhao|2022|CSD Communication|||
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/ccdc.csd.cc2bly30
title: CCDC 2163152: Experimental Crystal Structure Determination

description: Related Article: Mrinal Bhunia, Christian Sandoval-Pauker, Mehrafshan Jafari, Lauren Grant, Michael R. Gau, Balázs Pintér, Daniel J. Mindiola|2022|Angew.Chem.,Int.Ed.|61|e202209122|doi:10.1002/anie.202209122
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/ccdc.csd.cc2blz42
title: CCDC 2163184: Experimental Crystal Structure Determination

description: Related Article: Xiu‐Lian Zhang, Jun Gu, Wen‐Hao Cui, Zhiwen Ye, Wenbin Yi, Qiang Zhang, Ying He|2022|Angew.Chem.,Int.Ed.|61|e202210456|doi:10.1002/anie.202210456
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/ccdc.csd.cc2bm37b
title: CCDC 2163311: Experimental Crystal Structure Determination

description: Related Article: Fangxiang Sun, Shuaimin Tan, Hou‐Ji Cao, Jingkai Xu, Vladimir I. Bregadze, Deshuang Tu, Changsheng Lu, Hong Yan|2022|Angew.Chem.,Int.Ed.|61|e202207125|doi:10.1002/anie.202207125
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/ccdc.csd.cc2bm38c
title: CCDC 2163312: Experimental Crystal Structure Determination

description: Related Article: Fangxiang Sun, Shuaimin Tan, Hou‐Ji Cao, Jingkai Xu, Vladimir I. Bregadze, Deshuang Tu, Changsheng Lu, Hong Yan|2022|Angew.Chem.,Int.Ed.|61|e202207125|doi:10.1002/anie.202207125
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/ccdc.csd.cc2bm39d
title: CCDC 2163313: Experimental Crystal Structure Determination

description: Related Article: Fangxiang Sun, Shuaimin Tan, Hou‐Ji Cao, Jingkai Xu, Vladimir I. Bregadze, Deshuang Tu, Changsheng Lu, Hong Yan|2022|Angew.Chem.,Int.Ed.|61|e202207125|doi:10.1002/anie.202207125
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/ccdc.csd.cc2bm8s1
title: CCDC 2163483: Experimental Crystal Structure Determination

description: Related Article: Yan Xia, Jie Li, Xu Chen, Anran Li, Kunpeng Guo, Fei Chen, Bo Zhao, Zhikuan Chen, Hua Wang|2022|Chem.-Eur.J.|28|e202202434|doi:10.1002/chem.202202434
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/ccdc.csd.cc2bm94f
title: CCDC 2163494: Experimental Crystal Structure Determination

description: Related Article: Yan Xia, Jie Li, Xu Chen, Anran Li, Kunpeng Guo, Fei Chen, Bo Zhao, Zhikuan Chen, Hua Wang|2022|Chem.-Eur.J.|28|e202202434|doi:10.1002/chem.202202434
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/ccdc.csd.cc2bmc2f
title: CCDC 2163554: Experimental Crystal Structure Determination

description: Related Article: Shangshang Wang, Min Tang, Lin Wu, Lifang Bian, Liang Jiang, Jiali Liu, Zheng‐Bin Tang, Yimin Liang, Zhichang Liu|2022|Angew.Chem.,Int.Ed.|61|e202205658|doi:10.1002/anie.202205658
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/ccdc.csd.cc2bmc4h
title: CCDC 2163556: Experimental Crystal Structure Determination

description: Related Article: Shangshang Wang, Min Tang, Lin Wu, Lifang Bian, Liang Jiang, Jiali Liu, Zheng‐Bin Tang, Yimin Liang, Zhichang Liu|2022|Angew.Chem.,Int.Ed.|61|e202205658|doi:10.1002/anie.202205658
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/ccdc.csd.cc2bmd3h
title: CCDC 2163586: Experimental Crystal Structure Determination

description: Related Article: Wei Yuan, Xujiang Zhu, Yankun Xu, Chuan He|2022|Angew.Chem.,Int.Ed.|61|e202204912|doi:10.1002/anie.202204912
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5281/zenodo.7855788
title: Convocatorias de empleo público

description: Convocatorias con plazo abierto de empleo público a fecha de 22 de abril de 2023.
DOI: 10.5281/zenodo.7855787
title: Convocatorias de empleo público

description: Convocatorias con plazo abierto de empleo público a fecha de 22 de abril de 2023.
DOI: 10.34740/kaggle/dsv/5491155
title: Youtube Trending Video - Taiwan & Hong Kong
DOI: 10.25345/c5901zr9g
title: MassIVE MSV000091781 - Identification of ubiquitin interactors in Legionella pneumophila using ubiquitin activity-based probes
title: In this experiments, we used several ubiquitin activity-based probes (Ub-Prg, Ub-VME, and Ub-VS) to covalently capture ubiquitin-interacting proteins in Legionella pneumophila. These enriched interactome were analyzed by LC-MS/MS to identify Legionella effectors uniquely captured by the probes.
DOI: 10.34740/kaggle/dsv/5491074
title: Landmarks Dataset
DOI: 10.5517/ccdc.csd.cc2bmd4j
title: CCDC 2163587: Experimental Crystal Structure Determination

description: Related Article: Wei Yuan, Xujiang Zhu, Yankun Xu, Chuan He|2022|Angew.Chem.,Int.Ed.|61|e202204912|doi:10.1002/anie.202204912
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/ccdc.csd.cc2bmdcr
title: CCDC 2163594: Experimental Crystal Structure Determination

description: Related Article: Michał Jerzy Jadwiszczak, Przemysław Jan Malinowski|2023|Chem.-Eur.J.|29|e202202976|doi:10.1002/chem.202202976
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/ccdc.csd.cc2bdfz5
title: CCDC 2156917: Experimental Crystal Structure Determination

description: Related Article: John A. Seed, Lisa Vondung, Franky Barton, Ashley J. Wooles, Erli Lu, Matthew Gregson, Ralph W. Adams, Stephen T. Liddle|2022|Chem.-Eur.J.|28|e202200761|doi:10.1002/chem.202200761
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/ccdc.csd.cc2bdg07
title: CCDC 2156918: Experimental Crystal Structure Determination

description: Related Article: John A. Seed, Lisa Vondung, Franky Barton, Ashley J. Wooles, Erli Lu, Matthew Gregson, Ralph W. Adams, Stephen T. Liddle|2022|Chem.-Eur.J.|28|e202200761|doi:10.1002/chem.202200761
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/ccdc.csd.cc2bdfy4
title: CCDC 2156916: Experimental Crystal Structure Determination

description: Related Article: John A. Seed, Lisa Vondung, Franky Barton, Ashley J. Wooles, Erli Lu, Matthew Gregson, Ralph W. Adams, Stephen T. Liddle|2022|Chem.-Eur.J.|28|e202200761|doi:10.1002/chem.202200761
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/ccdc.csd.cc2bdfw2
title: CCDC 2156914: Experimental Crystal Structure Determination

description: Related Article: John A. Seed, Lisa Vondung, Franky Barton, Ashley J. Wooles, Erli Lu, Matthew Gregson, Ralph W. Adams, Stephen T. Liddle|2022|Chem.-Eur.J.|28|e202200761|doi:10.1002/chem.202200761
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/ccdc.csd.cc2bdfx3
title: CCDC 2156915: Experimental Crystal Structure Determination

description: Related Article: John A. Seed, Lisa Vondung, Franky Barton, Ashley J. Wooles, Erli Lu, Matthew Gregson, Ralph W. Adams, Stephen T. Liddle|2022|Chem.-Eur.J.|28|e202200761|doi:10.1002/chem.202200761
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/ccdc.csd.cc2bdfry
title: CCDC 2156910: Experimental Crystal Structure Determination

description: Related Article: John A. Seed, Lisa Vondung, Franky Barton, Ashley J. Wooles, Erli Lu, Matthew Gregson, Ralph W. Adams, Stephen T. Liddle|2022|Chem.-Eur.J.|28|e202200761|doi:10.1002/chem.202200761
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/ccdc.csd.cc2bdfsz
title: CCDC 2156911: Experimental Crystal Structure Determination

description: Related Article: John A. Seed, Lisa Vondung, Franky Barton, Ashley J. Wooles, Erli Lu, Matthew Gregson, Ralph W. Adams, Stephen T. Liddle|2022|Chem.-Eur.J.|28|e202200761|doi:10.1002/chem.202200761
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/ccdc.csd.cc2bdfpw
title: CCDC 2156908: Experimental Crystal Structure Determination

description: Related Article: John A. Seed, Lisa Vondung, Franky Barton, Ashley J. Wooles, Erli Lu, Matthew Gregson, Ralph W. Adams, Stephen T. Liddle|2022|Chem.-Eur.J.|28|e202200761|doi:10.1002/chem.202200761
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/ccdc.csd.cc2bdfqx
title: CCDC 2156909: Experimental Crystal Structure Determination

description: Related Article: John A. Seed, Lisa Vondung, Franky Barton, Ashley J. Wooles, Erli Lu, Matthew Gregson, Ralph W. Adams, Stephen T. Liddle|2022|Chem.-Eur.J.|28|e202200761|doi:10.1002/chem.202200761
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.