Study : T0744
(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: 37
(Click on Model to display complexes with selected ligand(s))
based on
1F5V
Atome Sc:
62.11
Type:
No conserved side chain are recalculated after transfer of ligand
Ligand
Origin
Active Site
pKd (Avg)
Cofactor
Transfer
Information
FMN_C_3
1F5V
C7_S1
-5.0
-
Raw
FLAVIN MONONUCLEOTIDE
FMN_A_3
1VFR
C7_S1
-4.9
-
Raw
FLAVIN MONONUCLEOTIDE
FMN_A_3
2WZV
C7_S1
-3.8
-
Raw
FLAVIN MONONUCLEOTIDE
FMN_A_2
3H4O
C7_S1
-3.6
-
Raw
FLAVIN MONONUCLEOTIDE
based on
1VFR
Atome Sc:
78.70
Type:
No conserved side chain are recalculated after transfer of ligand
Ligand
Origin
Active Site
pKd (Avg)
Cofactor
Transfer
Information
FMN_A_3
1VFR
C7_S1
-3.8
-
Raw
FLAVIN MONONUCLEOTIDE
based on
1ICR
Atome Sc:
87.14
Type:
No conserved side chain are recalculated after transfer of ligand
Ligand
Origin
Active Site
pKd (Avg)
Cofactor
Transfer
Information
FMN_A_3
1VFR
C7_S1
-3.9
-
Raw
FLAVIN MONONUCLEOTIDE
based on
1YWQ
Atome Sc:
61.63
Type:
No conserved side chain are recalculated after transfer of ligand
Ligand
Origin
Active Site
pKd (Avg)
Cofactor
Transfer
Information
FMN_A_3
2WZV
C7_S1
-3.8
-
Raw
FLAVIN MONONUCLEOTIDE