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Ligand · RCW

RCW · 4-bromanyl-2-(4~{H}-1,2,4-triazol-3-yl)aniline

RCW, 4-bromanyl-2-(4~{H}-1,2,4-triazol-3-yl)aniline (C8 H7 Br N4, 239.1 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues within 4.5 Å, the residues it binds most and the…

Component
RCW
Formula
C8 H7 Br N4
Class
ligand
Structures
2
PDB entries
1

Binding sites

RCW in 2 structures; the first of them:

  • 7AH6 · Crystal structure of indoleamine 2,3-dioxygenase 1 (IDO1) in complex with ferric heme and… · RCW A502 · binds TYR126, CYS129, VAL130, PHE163, PHE164, SER167, LEU234, GLY262 and 3 more
  • 7AH6 · Crystal structure of indoleamine 2,3-dioxygenase 1 (IDO1) in complex with ferric heme and… · RCW A502 · binds TYR126, CYS129, VAL130, PHE163, SER167, GLY262, SER263, ALA264

Residues it binds most

PHE 8, LEU 6, SER 4, VAL 7, HIS 6, ALA 4, ARG 4, CYS 4, GLY 4, TYR 4 (residue and the binding sites it lines).

Found with

  • HEM · Protoporphyrin IX containing Fe
  • GOL · Glycerol

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