Ligand · UIR
UIR · (1r,3as,4r,8as,8br)-4-(2-benzo[1,3]dioxol-5-yl-1-cyclopropyl-3-oxo-decahydro-pyrrolo[3,4-a]pyrrolizin-4-yl)-benzamidine
UIR, (1r,3as,4r,8as,8br)-4-(2-benzo[1,3]dioxol-5-yl-1-cyclopropyl-3-oxo-decahydro-pyrrolo[3,4-a]pyrrolizin-4-yl)-benzamidine (C27 H30 N4 O3, 458.6 g/mol), in the MolNFT structures on GenesisL1: bound in 6 records (3 PDB entries). Every…
- Component
- UIR
- Formula
- C27 H30 N4 O3
- Class
- ligand
- Structures
- 6
- PDB entries
- 3
Binding sites
UIR in 6 structures; the first of them:
- 1Y3V · Trypsin Inhibitor Complex · UIR A1994 · binds HIS57, ASN97, THR98, LEU99, GLN175, ASP189, SER190, CYS191 and 11 more
- 1Y3Y · Trypsin inhibitor complex · UIR A2222 · binds HIS57, ASP189, SER190, CYS191, GLN192, GLY193, SER195, VAL213 and 8 more
- 1YPG · Thrombin Inhibitor Complex · UIR H5555 · binds HIS57, TYR60A, TRP60D, GLU97A, ASN98, LEU99, ILE174, ASP189 and 10 more
- 1Y3V · Trypsin inhibitor complex · UIR A1994 · binds HIS57, ASN97, THR98, LEU99, GLN175, ASP189, SER190, CYS191 and 11 more
- 1Y3Y · Trypsin inhibitor complex · UIR A2222 · binds HIS57, ASP189, SER190, CYS191, GLN192, GLY193, SER195, VAL213 and 8 more
- 1YPG · Thrombin inhibitor complex · UIR H5555 · binds HIS57, TYR60A, TRP60D, GLU97A, ASN98, LEU99, ILE174, ASP189 and 10 more
Residues it binds most
GLY 6, SER 6, CYS 6, TRP 6, ASP 6, GLN 4, HIS 6, TYR 6, VAL 6, ASN 4 (residue and the binding sites it lines).
Found with
- CA · Calcium ion
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