Ligand · HTQ

HTQ · Homotropine

HTQ, Homotropine (C16 H21 N O3, 275.3 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 found with it.

Component: HTQ
Formula: C16 H21 N O3
Class: ligand
Structures: 4
PDB entries: 2

Binding sites

HTQ in 4 structures; the first of them:

1MX5 · Crystal Structure of Human Liver Carboxylesterase in complexed with homatropine, a… · HTQ A111 · binds ALA1093, LEU1097, PHE1101, GLY1142, GLY1143, VAL1146, SER1221, ALA1222 and 12 more
2DQZ · Crystal structure of human carboxylesterase in complex with homatropine, coenzyme A, and… · HTQ A11 · binds GLY1356, TRP1357, PRO1360, MET1361, TYR1366, LEU1368, SER1369, GLY1371 and 2 more
1MX5 · Crystal structure of human liver carboxylesterase in complexed with homatropine, a… · HTQ A111 · binds ALA1093, LEU1097, PHE1101, GLY1142, GLY1143, VAL1146, SER1221, ALA1222 and 12 more
2DQZ · Crystal structure of human carboxylesterase in complex with homatropine, coenzyme a, and… · HTQ A11 · binds GLY1356, TRP1357, PRO1360, MET1361, TYR1366, LEU1368, SER1369, GLY1371 and 2 more

Residues it binds most

LEU 30, GLY 30, VAL 22, SER 30, MET 22, PHE 12, PRO 18, LYS 18, TRP 18, ALA 8 (residue and the binding sites it lines).

Found with

NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose
SIA · N-acetyl-alpha-neuraminic acid
COA · Coenzyme A
PLM · Palmitic acid
CL · Chloride ion
F · Fluoride ion
SO4 · Sulfate ion

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