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Ligand · BQW

BQW · (2~{R})-2-carbamimidamido-~{N}-(4-ethanoyl-1,3-thiazolidin-2-yl)propanamide

BQW, (2~{R})-2-carbamimidamido-~{N}-(4-ethanoyl-1,3-thiazolidin-2-yl)propanamide (C9 H17 N5 O2 S, 259.3 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…

Component
BQW
Formula
C9 H17 N5 O2 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

BQW in 2 structures; the first of them:

  • 6EPX · The ATAD2 bromodomain in complex with compound 3 · BQW A1201 · binds VAL1008, PHE1009, VAL1013, TYR1021, ALA1060, TYR1063, ASN1064, GLY1070 and 2 more
  • 6EPX · The ATAD2 bromodomain in complex with compound 3 · BQW A1201 · binds VAL1008, PHE1009, VAL1013, TYR1021, ALA1060, TYR1063, ASN1064, GLY1070 and 2 more

Residues it binds most

ASP 4, TYR 2, VAL 2, ALA 2, ARG 2, ASN 2, CYS 2, GLY 2, HIS 2, ILE 2 (residue and the binding sites it lines).

Found with

  • SO4 · Sulfate ion

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