Study : T0712
(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: 74
(Click on Model to display complexes with selected ligand(s))
based on
3H8T
Atome Sc:
88.35
Type:
No conserved side chain are recalculated after transfer of ligand
Ligand
Origin
Active Site
pKd (Avg)
Cofactor
Transfer
Information
HEM_A_3
3H8T
C7_S1
-6.7
-
Raw
PROTOPORPHYRIN IX CONTAINING FE
UNL_B_12
3U22
C7_S1
-3.0
-
Raw
UNKNOWN LIGAND
based on
3U22
Atome Sc:
80.66
Type:
No conserved side chain are recalculated after transfer of ligand
Ligand
Origin
Active Site
pKd (Avg)
Cofactor
Transfer
Information
HEM_A_3
3H8T
C7_S1
-4.6
-
Raw
PROTOPORPHYRIN IX CONTAINING FE
UNL_B_12
3U22
C7_S1
-3.1
-
Raw
UNKNOWN LIGAND