Project Summary CHOLIC ACID - Bioactive Conformational Ensemble

Molecule information

Bioactive Conformational Ensemble ID	BAC0010626
Ligand ID	CHD
PDB ID	2QO4
Experiment Type	X-RAY DIFFRACTION
Resolution	1.5 Å
Subset(s)	Overall Benchmark

Molecule properties

Smiles

C1C[C@@H](O)C[C@H]2C[C@@H](O)[C@@H]3[C@@H]([C@@]12C)C[C@H](O)[C@]1([C@H]3CC[C@@H]1[C@H](C)CCC(=O)O)C

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Cholic acid (CHD) Summary