Ligand · B46
B46 · prop-2-yn-1-yl {[5-(4-piperidin-1-yl-2-pyridin-3-yl-1,3-thiazol-5-yl)-1H-pyrazol-3-yl]methyl}carbamate
B46, prop-2-yn-1-yl {[5-(4-piperidin-1-yl-2-pyridin-3-yl-1,3-thiazol-5-yl)-1H-pyrazol-3-yl]methyl}carbamate (C21 H22 N6 O2 S, 422.5 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with…
- Component
- B46
- Formula
- C21 H22 N6 O2 S
- Class
- ligand
- Structures
- 2
- PDB entries
- 1
Binding sites
B46 in 2 structures; the first of them:
- 3G7E · Crystal structure of E. coli Gyrase B co-complexed with PROP-2-YN-1-YL… · B46 A1 · binds VAL43, ASN46, ALA47, ASP49, GLU50, ASP73, ARG76, GLY77 and 15 more
- 3G7E · Crystal structure of E. COLI gyrase B co-complexed with prop-2-yn-1-yl… · B46 A1 · binds VAL43, ASN46, ALA47, ASP49, GLU50, ASP73, ARG76, GLY77 and 15 more
Residues it binds most
ASP 2, GLY 2, VAL 2, ARG 2, ILE 2, LEU 2, ALA 2, ASN 2, GLU 2, MET 2 (residue and the binding sites it lines).
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