Ligand · X3A

X3A · [4-amino-2-(phenylamino)-1,3-thiazol-5-yl](pyridin-3-yl)methanone

X3A, [4-amino-2-(phenylamino)-1,3-thiazol-5-yl](pyridin-3-yl)methanone (C15 H12 N4 O S, 296.4 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues within 4.5 Å, the residues…

Component: X3A
Formula: C15 H12 N4 O S
Class: ligand
Structures: 2
PDB entries: 1

Binding sites

X3A in 2 structures; the first of them:

3QTW · CDK2 in complex with inhibitor RC-2-13 · X3A A451 · binds ILE10, GLY13, VAL18, ALA31, LYS33, VAL64, PHE80, GLU81 and 11 more
3QTW · CDK2 in complex with inhibitor rc-2-13 · X3A A451 · binds ILE10, GLY13, VAL18, ALA31, LYS33, VAL64, PHE80, GLU81 and 11 more

Residues it binds most

ALA 2, ASP 2, GLN 2, LEU 2, LYS 2, PHE 2, VAL 2, ASN 2, GLU 2, GLY 2 (residue and the binding sites it lines).

Found with

EDO · 1,2-ethanediol

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