PDBsum entry 3u51

Transferase/transferase inhibitor

PDB id: 3u51

Contents

Protein chains

256 a.a.

Ligands

FUM-P4E-ALC-08M-DAB-NH2 ×2

Waters ×122

PDB id:

3u51

Name:

Transferase/transferase inhibitor

Title:

Src in complex with DNA-templated macrocyclic inhibitor mc1

Structure:

Proto-oncogene tyrosine-protein kinase src. Chain: a, b. Fragment: src kinase domain (unp residues 259-533). Synonym: c-src kinase, proto-oncogenE C-src, pp60c-src, p60-src. Engineered: yes. Macrocyclic inhibitor mc1. Chain: c, d. Engineered: yes

Source:

Gallus gallus. Chicken. Organism_taxid: 9031. Gene: src. Expressed in: escherichia coli. Expression_system_taxid: 469008. Synthetic: yes

Resolution:

2.24Å R-factor: 0.200 R-free: 0.236

Authors:

M.A.Seeliger,D.R.Liu,G.Georghiou,R.E.Kleiner,M.Pulkoski-Gross

Key ref:

G.Georghiou et al. (2012). Highly specific, bisubstrate-competitive Src inhibitors from DNA-templated macrocycles. Nat Chem Biol, 8, 366-374. PubMed id: 22344177

Date:

10-Oct-11 Release date: 22-Feb-12

Protein chains

P00523  (SRC_CHICK) -  Proto-oncogene tyrosine-protein kinase Src from Gallus gallus

Seq: 533 a.a.

Struc: 256 a.a.

Enzyme reactions

• Enzyme class: E.C.2.7.10.2 - non-specific protein-tyrosine kinase.
• Reaction: L-tyrosyl-[protein] + ATP = O-phospho-L-tyrosyl-[protein] + ADP + H⁺

L-tyrosyl-[protein] + ATP = O-phospho-L-tyrosyl-[protein] (Bound ligand (Het Group name = 08M) matches with 48.28% similarity) + ADP + H(+)

Molecule diagrams generated from .mol files obtained from the KEGG ftp site

Added reference

Nat Chem Biol 8:366-374 (2012)

PubMed id: 22344177

Highly specific, bisubstrate-competitive Src inhibitors from DNA-templated macrocycles.

G.Georghiou, R.E.Kleiner, M.Pulkoski-Gross, D.R.Liu, M.A.Seeliger.

ABSTRACT

No abstract given.