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Ligand · XP1

XP1 · 4-(dimethylamino)benzoic acid

XP1, 4-(dimethylamino)benzoic acid (C9 H11 N O2, 165.2 g/mol), in the MolNFT structures on GenesisL1: bound in 4 records (2 PDB entries). Every binding site with its residues within 4.5 Å, the residues it binds most and the ligands found…

Component
XP1
Formula
C9 H11 N O2
Class
ligand
Structures
4
PDB entries
2

Binding sites

XP1 in 4 structures; the first of them:

  • 2V6N · Crystal structures of the SARS-coronavirus main proteinase inactivated by benzotriazole… · XP1 A2307 · binds LEU27, PRO39, HIS41, MET49, CYS145, HIS163, HIS164, MET165 and 4 more
  • 2VJ1 · A Structural View of the Inactivation of the SARS-Coronavirus Main Proteinase by… · XP1 B1304 · binds HIS41, LEU141, ASN142, GLY143, SER144, CYS145, HIS163, HIS164 and 1 more
  • 2V6N · Crystal structures of the SARS-coronavirus main proteinase inactivated by benzotriazole… · XP1 A2307 · binds LEU27, PRO39, HIS41, MET49, CYS145, HIS163, HIS164, MET165 and 4 more
  • 2VJ1 · A structural view of the inactivation of the SARS-coronavirus main proteinase by… · XP1 B1304 · binds HIS41, LEU141, ASN142, GLY143, SER144, CYS145, HIS163, HIS164 and 1 more

Residues it binds most

HIS 4, CYS 4, LEU 4, MET 2, ARG 2, ASN 2, ASP 2, GLN 2, GLU 2, GLY 2 (residue and the binding sites it lines).

Found with

  • BEZ · Benzoic acid
  • SO4 · Sulfate ion
  • DMS · Dimethyl sulfoxide
  • MES · 2-(N-morpholino)-ethanesulfonic acid

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