Ligand · 696
696 · 3-{5-[amino(iminio)methyl]-1H-indol-2-yl}-1,1'-biphenyl-2-olate
696, 3-{5-[amino(iminio)methyl]-1H-indol-2-yl}-1,1'-biphenyl-2-olate (C21 H17 N3 O, 327.4 g/mol), in the MolNFT structures on GenesisL1: bound in 10 records (5 PDB entries). Every binding site with its residues within 4.5 Å, the residues…
- Component
- 696
- Formula
- C21 H17 N3 O
- Class
- ligand
- Structures
- 10
- PDB entries
- 5
Binding sites
696 in 10 structures; the first of them:
- 1O2G · Elaborate Manifold of Short Hydrogen Bond Arrays Mediating Binding of Active… · 696 H410 · binds LEU41, CYS42, HIS57, CYS58, TYR60A, TRP60D, LYS60F, ASP189 and 11 more
- 1O3E · Elaborate Manifold of Short Hydrogen Bond Arrays Mediating Binding of Active… · 696 A246 · binds PHE41, CYS42, HIS57, CYS58, ASP189, SER190, CYS191, GLN192 and 10 more
- 1O3F · Elaborate Manifold of Short Hydrogen Bond Arrays Mediating Binding of Active… · 696 A246 · binds PHE41, CYS42, HIS57, CYS58, ASP189, SER190, CYS191, GLN192 and 10 more
- 1O3G · Elaborate Manifold of Short Hydrogen Bond Arrays Mediating Binding of Active… · 696 A246 · binds PHE41, CYS42, HIS57, CYS58, ASP189, SER190, CYS191, GLN192 and 10 more
- 1O5A · Dissecting and Designing Inhibitor Selectivity Determinants at the S1 site Using an… · 696 B251 · binds VAL41, CYS42, HIS57, CYS58, ASP189, ALA190, CYS191, GLN192 and 9 more
- 1O2G · Elaborate manifold of short hydrogen bond arrays mediating binding of active… · 696 H410 · binds LEU41, CYS42, HIS57, CYS58, TYR60A, TRP60D, LYS60F, ASP189 and 11 more
- 1O3E · Elaborate manifold of short hydrogen bond arrays mediating binding of active… · 696 A246 · binds PHE41, CYS42, HIS57, CYS58, ASP189, SER190, CYS191, GLN192 and 10 more
- 1O3F · Elaborate manifold of short hydrogen bond arrays mediating binding of active… · 696 A246 · binds PHE41, CYS42, HIS57, CYS58, ASP189, SER190, CYS191, GLN192 and 10 more
- 1O3G · Elaborate manifold of short hydrogen bond arrays mediating binding of active… · 696 A246 · binds PHE41, CYS42, HIS57, CYS58, ASP189, SER190, CYS191, GLN192 and 10 more
- 1O5A · Dissecting and designing inhibitor selectivity determinants at the S1 site using an… · 696 B251 · binds VAL41, CYS42, HIS57, CYS58, ASP189, ALA190, CYS191, GLN192 and 9 more
Residues it binds most
CYS 10, GLY 10, SER 10, TRP 10, VAL 10, ASP 10, HIS 10, GLN 8, TYR 8, PHE 6 (residue and the binding sites it lines).
Found with
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