Ligand · T87
T87 · [(1-{2[(4-carbamimidoyl-phenylamino)-methyl]-1-methyl-1H-benzoimidazol-5-yl}-cyclopropyl)-pyridin-2-yl-methyleneaminooxy]-acetic acid ethyl ester
T87, [(1-{2[(4-carbamimidoyl-phenylamino)-methyl]-1-methyl-1H-benzoimidazol-5-yl}-cyclopropyl)-pyridin-2-yl-methyleneaminooxy]-acetic acid ethyl ester (C29 H31 N7 O3, 525.6 g/mol), in the MolNFT structures on GenesisL1: bound in 6 records…
- Component
- T87
- Formula
- C29 H31 N7 O3
- Class
- ligand
- Structures
- 6
- PDB entries
- 3
Binding sites
T87 in 6 structures; the first of them:
- 1G2L · Factor xa inhibitor complex · T87 A1 · binds HIS57, GLU98, THR99, TYR100, PHE177, ASP194, ALA195, CYS196 and 11 more
- 1G30 · Thrombin inhibitor complex · T87 B1 · binds HIS57, TYR60A, TRP60D, GLU97A, ASN98, LEU99, ILE174, ASP189 and 12 more
- 1OYQ · Trypsin inhibitor complex · T87 A1 · binds HIS57, ASN97, THR98, LEU99, GLN175, ASP189, SER190, CYS191 and 11 more
- 1G2L · Factor xa inhibitor complex · T87 A1 · binds HIS57, GLU98, THR99, TYR100, PHE177, ASP194, ALA195, CYS196 and 11 more
- 1G30 · Thrombin inhibitor complex · T87 B1 · binds HIS57, TYR60A, TRP60D, GLU97A, ASN98, LEU99, ILE174, ASP189 and 12 more
- 1OYQ · Trypsin inhibitor complex · T87 A1 · binds HIS57, ASN97, THR98, LEU99, GLN175, ASP189, SER190, CYS191 and 11 more
Residues it binds most
GLY 6, SER 6, CYS 6, GLU 4, TRP 6, ASP 6, GLN 4, HIS 6, TYR 6, VAL 6 (residue and the binding sites it lines).
Found with
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