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Ligand · 9TB

9TB · (2~{S})-2-[[(2~{S})-6-[(4-fluorophenyl)methylamino]-1-oxidanyl-1,6-bis(oxidanylidene)hexan-2-yl]carbamoylamino]pentanedioic acid

9TB, (2~{S})-2-[[(2~{S})-6-[(4-fluorophenyl)methylamino]-1-oxidanyl-1,6-bis(oxidanylidene)hexan-2-yl]carbamoylamino]pentanedioic acid (C19 H24 F N3 O8, 441.4 g/mol), in the MolNFT structures on GenesisL1: bound in 1 record (1 PDB entry).…

Component
9TB
Formula
C19 H24 F N3 O8
Class
ligand
Structures
1
PDB entries
1

Binding sites

9TB in 1 structure; the first of them:

  • 5OF0 · X-ray structure of human glutamate carboxypeptidase II (GCPII), the E424M inactive… · 9TB A822 · binds PHE209, ARG210, GLY256, ASN257, ASP387, MET424, GLU425, GLY427 and 16 more

Residues it binds most

ARG 1, ASP 1, GLY 1, ASN 1, GLU 1, PHE 1, TYR 1, ALA 1, HIS 1, LEU 1 (residue and the binding sites it lines).

Found with

  • CA · Calcium ion
  • ZN · Zinc ion
  • BMA · beta-D-mannopyranose
  • MAN · alpha-D-mannopyranose
  • NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose
  • CL · Chloride ion

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