PDBsum entry 5kup

Transferase/transferase inhibitor

PDB id: 5kup

Contents

Protein chain

265 a.a.

Ligands

SO4 ×2

GOL ×2

PG0

6XL

Waters ×319

PDB id:

5kup

Name:

Transferase/transferase inhibitor

Title:

Bruton's tyrosine kinase (btk) with pyridazinone compound 9

Structure:

Tyrosine-protein kinase btk. Chain: a. Synonym: agammaglobulinemia tyrosine kinase,atk,b-cell progenitor kinase,bpk,bruton tyrosine kinase. Engineered: yes

Source:

Homo sapiens. Human. Organism_taxid: 9606. Gene: btk, agmx1, atk, bpk. Expressed in: spodoptera frugiperda. Expression_system_taxid: 7108

Resolution:

1.39Å R-factor: 0.166 R-free: 0.177

Authors:

C.Eigenbrot,C.Yu

Key ref:

A.R.Johnson et al. (2016). Battling Btk Mutants With Noncovalent Inhibitors That Overcome Cys481 and Thr474 Mutations. Acs Chem Biol, 11, 2897-2907. PubMed id: 27571029 DOI: 10.1021/acschembio.6b00480

Date:

13-Jul-16 Release date: 14-Sep-16

Protein chain

Q06187  (BTK_HUMAN) -  Tyrosine-protein kinase BTK from Homo sapiens

Seq: 659 a.a.

Struc: 265 a.a.*

* PDB and UniProt seqs differ at 1 residue position (black cross)

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⁺

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

Added reference

DOI no: 10.1021/acschembio.6b00480

Acs Chem Biol 11:2897-2907 (2016)

PubMed id: 27571029

Battling Btk Mutants With Noncovalent Inhibitors That Overcome Cys481 and Thr474 Mutations.

A.R.Johnson, P.B.Kohli, A.Katewa, E.Gogol, L.D.Belmont, R.Choy, E.Penuel, L.Burton, C.Eigenbrot, C.Yu, D.F.Ortwine, K.Bowman, Y.Franke, C.Tam, A.Estevez, K.Mortara, J.Wu, H.Li, M.Lin, P.Bergeron, J.J.Crawford, W.B.Young.

ABSTRACT

No abstract given.