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Ligand · KLB

KLB · 5-(1~{H}-imidazol-5-yl)-4-phenyl-thiophene-2-carboximidamide

KLB, 5-(1~{H}-imidazol-5-yl)-4-phenyl-thiophene-2-carboximidamide (C14 H12 N4 S, 268.3 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 residues it…

Component
KLB
Formula
C14 H12 N4 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

KLB in 2 structures; the first of them:

  • 6RWH · Fragment AZ-007 binding at a primary and secondary binding site of the the… · KLB A301 · binds GLU14, CYS38, GLU39, ASN42, LEU43, VAL46
  • 6RWH · Fragment az-007 binding at a primary and secondary binding site of the the… · KLB A301 · binds GLU14, CYS38, GLU39, ASN42, LEU43, VAL46

Residues it binds most

LEU 4, ASP 2, GLU 2, ASN 2, CYS 2, GLN 2, ILE 2, TYR 2, VAL 2 (residue and the binding sites it lines).

Found with

  • CA · Calcium ion
  • MG · Magnesium ion

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