Ligand · A1A51

A1A51 · ethyl 1,4-dimethyl-5-{[6-(trifluoromethyl)pyridin-3-yl]methyl}-1H-pyrazole-3-carboxylate

A1A51, ethyl 1,4-dimethyl-5-{[6-(trifluoromethyl)pyridin-3-yl]methyl}-1H-pyrazole-3-carboxylate (C15 H16 F3 N3 O2, 327.3 g/mol), in the MolNFT structures on GenesisL1: bound in 1 record (1 PDB entry). Every binding site with its residues…

Component: A1A51
Formula: C15 H16 F3 N3 O2
Class: ligand
Structures: 1
PDB entries: 1

Binding sites

A1A51 in 1 structure; the first of them:

9DI6 · Crystal structure of Plasmodium falciparum dihydroorotate dehydrogenase bound with… · A1A51 A1001 · binds TYR168, PHE171, LEU172, CYS175, LEU176, GLY181, GLU182, CYS184 and 11 more

Residues it binds most

LEU 1, PHE 1, CYS 1, TYR 1, ARG 1, GLU 1, GLY 1, HIS 1, ILE 1, MET 1 (residue and the binding sites it lines).

Found with

FMN · Flavin mononucleotide
OG6 · 6-[bis(oxidanyl)methyl]-5~{H}-pyrimidine-2,4-dione
CIT · Citric acid
LDA · Lauryl dimethylamine-N-oxide

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