Ligand · 995
995 · 4-methyl-pentanoic acid {1-[4-guanidino-1-(thiazole-2-carbonyl)-butylcarbamoyl]-2-methyl-propyl}-amide
995, 4-methyl-pentanoic acid {1-[4-guanidino-1-(thiazole-2-carbonyl)-butylcarbamoyl]-2-methyl-propyl}-amide (C20 H36 N6 O3 S, 440.6 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with…
- Component
- 995
- Formula
- C20 H36 N6 O3 S
- Class
- ligand
- Structures
- 2
- PDB entries
- 1
Binding sites
995 in 2 structures; the first of them:
- 1ZPB · Crystal Structure of the Catalytic Domain of Coagulation Factor XI in Complex with… · 995 A301 · binds HIS57, ALA97, GLU98, HIS174, ASP189, ALA190, CYS191, LYS192 and 12 more
- 1ZPB · Crystal structure of the catalytic domain of coagulation factor XI in complex with… · 995 A301 · binds HIS57, ALA97, GLU98, HIS174, ASP189, ALA190, CYS191, LYS192 and 12 more
Residues it binds most
GLY 2, ALA 2, ASP 2, CYS 2, GLU 2, HIS 2, SER 2, LYS 2, THR 2, TRP 2 (residue and the binding sites it lines).
Found with
- SO4 · Sulfate ion
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