Complexes after comparative docking

Receptor: model based on 3UCD chain:A
& Ligands found in homologous templates


Theoretical pKd : [ ‹nMol | ‹μMol | ‹mMol | ›mMol] - Values:

Score for Scwrl (Unconserved side chains of binding site are recalculated) model :

Result RMS (ca) pKd Avg. Q PSim Ligand Name : Origin Transfer
2PG_A_5 0.000 4.5 0.81 84.4 2-PHOSPHOGLYCERIC ACID 3UCD Raw