Ligand · 9PY
9PY · (2R)-2-methyl-3-dehydroquinic acid
9PY, (2R)-2-methyl-3-dehydroquinic acid (C8 H12 O6, 204.2 g/mol), in the MolNFT structures on GenesisL1: bound in 4 records (2 PDB entries). Every binding site with its residues within 4.5 Å, the residues it binds most and the ligands…
- Component
- 9PY
- Formula
- C8 H12 O6
- Class
- ligand
- Structures
- 4
- PDB entries
- 2
Binding sites
9PY in 4 structures; the first of them:
- 4CL0 · Structure of the Mycobacterium tuberculosis Type II Dehydroquinase inhibited by a… · 9PY A1143 · binds PRO11, LEU13, ARG19, TYR24, ASN75, GLY77, GLY78, HIS81 and 6 more
- 4CNO · Structure of the Salmonella typhi Type I dehydroquinase inhibited by a 3-dehydroquinic… · 9PY A301 · binds SER21, GLU46, ARG48, HIS143, LYS170, ALA172, MET203, MET205 and 3 more
- 4CL0 · Structure of the mycobacterium tuberculosis type II dehydroquinase inhibited by a… · 9PY A1143 · binds PRO11, LEU13, ARG19, TYR24, ASN75, GLY77, GLY78, HIS81 and 6 more
- 4CNO · Structure of the salmonella typhi type I dehydroquinase inhibited by a 3-dehydroquinic… · 9PY A301 · binds SER21, GLU46, ARG48, HIS143, LYS170, ALA172, MET203, MET205 and 3 more
Residues it binds most
ARG 10, MET 8, PHE 8, HIS 8, SER 10, GLN 8, GLU 8, LYS 8, ALA 4, GLY 2 (residue and the binding sites it lines).
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