GOLD results for 2DBL Back to GOLD Validation Results Page GOLD results for 2DBL Note these results were obtained with a pre-release version of GOLD, and results from Version 1.0 of the program may differ. Also, attempts to reproduce the results will inevitably produce slightly different answers because of the non-deterministic nature of genetic algorithms. Steroid ligand with carboxylate side chain.
Ligand has a very non-planar ester group, which is surely wrong.
The GOLD prediction is displayed coloured by atom type, while the crystal structure is shown in green. The crystal structure coordinates have been translated so that the origin is at the centre of the active site. Reference coordinates The ligand in its crystal structure position, atom-typed and with hydrogens added.