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Ligand · BW2

BW2 · N-(4-{[(2-amino-4-oxo-3,4-dihydroquinazolin-6-yl)amino]sulfonyl}benzoyl)glutamic acid

BW2, N-(4-{[(2-amino-4-oxo-3,4-dihydroquinazolin-6-yl)amino]sulfonyl}benzoyl)glutamic acid (C20 H19 N5 O8 S, 489.5 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues within…

Component
BW2
Formula
C20 H19 N5 O8 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

BW2 in 2 structures; the first of them:

  • 1PL0 · Crystal structure of human ATIC in complex with folate-based inhibitor, BW2315U89UC · BW2 B802 · binds LYS266, HIS267, MET312, PHE315, GLY316, ASN489, ASN431, GLN449 and 8 more
  • 1PL0 · Crystal structure of human atic in complex with folate- based inhibitor, BW2315U89UC · BW2 B802 · binds LYS266, HIS267, MET312, PHE315, GLY316, ASN489, ASN431, GLN449 and 8 more

Residues it binds most

ASN 4, PHE 4, ASP 4, SER 4, ARG 4, GLN 4, GLY 4, HIS 4, ILE 4, LYS 4 (residue and the binding sites it lines).

Found with

  • AMZ · Aminoimidazole 4-carboxamide ribonucleotide
  • XMP · Xanthosine-5'-monophosphate
  • K · Potassium ion

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