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Ligand · 165

165 · N-(benzylsulfonyl)-3-cyclohexylalanyl-N-(2-amino-1,3-benzothiazol-6-yl)prolinamide

165, N-(benzylsulfonyl)-3-cyclohexylalanyl-N-(2-amino-1,3-benzothiazol-6-yl)prolinamide (C28 H35 N5 O4 S2, 569.7 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues within…

Component
165
Formula
C28 H35 N5 O4 S2
Class
ligand
Structures
2
PDB entries
1

Binding sites

165 in 2 structures; the first of them:

  • 1SB1 · Novel Non-Covalent Thrombin Inhibitors Incorporating P1 4,5,6,7-Tetrahydrobenzothiazole… · 165 H1001 · binds HIS57, TYR60A, TRP60D, GLU97A, ASN98, LEU99, GLU146, ILE174 and 14 more
  • 1SB1 · Novel non-covalent thrombin inhibitors incorporating P1 4,5,6,7- tetrahydrobenzothiazole… · 165 H1001 · binds HIS57, TYR60A, TRP60D, GLU97A, ASN98, LEU99, GLU146, ILE174 and 14 more

Residues it binds most

GLU 2, GLY 2, CYS 2, SER 2, TRP 2, ALA 2, ARG 2, ASN 2, ASP 2, HIS 2 (residue and the binding sites it lines).

Found with

  • NA · Sodium ion

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