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Ligand · A1AY8

A1AY8 · (3S)-1-[4-(4-methylpiperazin-1-yl)pyridine-2-carbonyl]-N-[(3M)-3-(3-oxo-2,3-dihydro-1H-isoindol-5-yl)phenyl]piperidine-3-carboxamide

A1AY8, (3S)-1-[4-(4-methylpiperazin-1-yl)pyridine-2-carbonyl]-N-[(3M)-3-(3-oxo-2,3-dihydro-1H-isoindol-5-yl)phenyl]piperidine-3-carboxamide (C31 H34 N6 O3, 538.6 g/mol), in the MolNFT structures on GenesisL1: bound in 1 record (1 PDB…

Component
A1AY8
Formula
C31 H34 N6 O3
Class
ligand
Structures
1
PDB entries
1

Binding sites

A1AY8 in 1 structure; the first of them:

  • 9CKJ · Co-crystal structure of 53BP1 tandem Tudor domains in complex with UNC9512 · A1AY8 A2001 · binds TYR1500, TYR1502, SER1503, PHE1519, ASP1520, ASP1521, LEU1547, PHE1553 and 13 more

Residues it binds most

PHE 6, TYR 6, ASP 6, ASN 6, SER 6, ARG 6, GLU 6, ILE 6, LEU 6, MET 6 (residue and the binding sites it lines).

Found with

  • UNX · Unknown atom or ion

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