Study : T0652 (models@predictioncenter.org)


Best Complexes after Comparative Docking:
Download: Best Ligands after Comparative Docking
Ligand Type Selected for this Study : Small Molecules; Peptides; Sugar; Nucleic Acid; Ions.
Number of Ligands Found in Study: 117

(Click on Model to display complexes with selected ligand(s))

based on 3HF7 Atome Sc:80.27Type: No conserved side chain are recalculated after transfer of ligand
Ligand Origin Active Site pKd (Avg) Cofactor Transfer Information
AMP_A_23HF7C2_S1-7.0-RawADENOSINE MONOPHOSPHATE
AMP_A_33JTFC2_S1-5.4-RawADENOSINE MONOPHOSPHATE
AMP_A_33LFRC2_S1-4.7-RawADENOSINE MONOPHOSPHATE
AMP_A_53NQRC2_S1-4.3-RawADENOSINE MONOPHOSPHATE
AMP_A_23LHHC2_S1-4.1-RawADENOSINE MONOPHOSPHATE
ADP_A_73OCMC2_S1-3.8-RawADENOSINE-5'-DIPHOSPHATE
ADN_A_33OI8C2_S1-3.5-RawADENOSINE

based on 1PVM Atome Sc:71.19Type: No conserved side chain are recalculated after transfer of ligand
Ligand Origin Active Site pKd (Avg) Cofactor Transfer Information
ADP_A_73OCMC2_S1-3.4-RawADENOSINE-5'-DIPHOSPHATE