Ligand · 9IC
9IC · (2S,3R)-2-azanyl-N-[(1R)-2-[3-(7-bromanyl-6-chloranyl-4-oxidanylidene-quinazolin-3-yl)propanoylamino]-1-(3-phenylphenyl)ethyl]-3-oxidanyl-butanamide
9IC, (2S,3R)-2-azanyl-N-[(1R)-2-[3-(7-bromanyl-6-chloranyl-4-oxidanylidene-quinazolin-3-yl)propanoylamino]-1-(3-phenylphenyl)ethyl]-3-oxidanyl-butanamide (C29 H29 Br Cl N5 O4, 626.9 g/mol), in the MolNFT structures on GenesisL1: bound in 2…
- Component
- 9IC
- Formula
- C29 H29 Br Cl N5 O4
- Class
- ligand
- Structures
- 2
- PDB entries
- 1
Binding sites
9IC in 2 structures; the first of them:
- 7WMI · Threonyl-tRNA synthetase from Salmonella enterica in complex with an inhibitor · 9IC A703 · binds TRP304, HIS309, TYR313, ALA316, MET317, PRO331, MET332, CYS334 and 15 more
- 7WMI · Threonyl-tRNA synthetase from salmonella enterica in complex with an inhibitor · 9IC A703 · binds HIS309, TYR313, ALA316, MET317, PRO331, MET332, CYS334, ARG363 and 12 more
Residues it binds most
ARG 4, HIS 4, ALA 4, CYS 4, MET 4, TYR 4, GLN 4, ASP 4, GLY 4, PHE 4 (residue and the binding sites it lines).
Found with
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