Ligand · 01T

01T · [5-(aminomethyl)-6-(2,2-dimethylpropyl)-2-ethyl-4-(4-methylphenyl)pyridin-3-yl]acetic acid

01T, [5-(aminomethyl)-6-(2,2-dimethylpropyl)-2-ethyl-4-(4-methylphenyl)pyridin-3-yl]acetic acid (C22 H30 N2 O2, 354.5 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues…

Component: 01T
Formula: C22 H30 N2 O2
Class: ligand
Structures: 2
PDB entries: 1

Binding sites

01T in 2 structures; the first of them:

3O95 · Crystal Structure of Human DPP4 Bound to TAK-100 · 01T A1 · binds ARG125, GLU205, GLU206, SER209, PHE357, TYR547, SER630, TYR631 and 6 more
3O95 · Crystal structure of human DPP4 bound to tak-100 · 01T A1 · binds ARG125, GLU205, GLU206, SER209, PHE357, TYR547, SER630, TYR631 and 6 more

Residues it binds most

TYR 8, GLU 8, SER 8, VAL 8, ARG 8, ASN 8, HIS 8, PHE 8, TRP 6 (residue and the binding sites it lines).

Found with

NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose

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