PDBsum entry 4gih

Transferase/transferase inhibitor

PDB id: 4gih

Contents

Protein chain

288 a.a.

Ligands

0X5

Waters ×119

PDB id:

4gih

Name:

Transferase/transferase inhibitor

Title:

Tyk2 (jh1) in complex with 2,6-dichloro-n-{2-[(cyclopropylcarbonyl) amino]pyridin-4-yl}benzamide

Structure:

Non-receptor tyrosine-protein kinase tyk2. Chain: a. Fragment: kinase domain, unp residues 885-1176. Engineered: yes. Mutation: yes

Source:

Homo sapiens. Human. Organism_taxid: 9606. Gene: tyk2. Expressed in: spodoptera frugiperda. Expression_system_taxid: 7108

Resolution:

2.00Å R-factor: 0.189 R-free: 0.217

Authors:

M.H.Ultsch

Key ref:

J.Liang et al. (2013). Lead identification of novel and selective TYK2 inhibitors. Eur J Med Chem, 67, 175-187. PubMed id: 23867602 DOI: 10.1016/j.ejmech.2013.03.070

Date:

08-Aug-12 Release date: 19-Jun-13

Protein chain

P29597  (TYK2_HUMAN) -  Non-receptor tyrosine-protein kinase TYK2 from Homo sapiens

Seq: 1187 a.a.

Struc: 288 a.a.*

* PDB and UniProt seqs differ at 7 residue positions (black crosses)

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: 10.1016/j.ejmech.2013.03.070

Eur J Med Chem 67:175-187 (2013)

PubMed id: 23867602

Lead identification of novel and selective TYK2 inhibitors.

J.Liang, V.Tsui, A.Van Abbema, L.Bao, K.Barrett, M.Beresini, L.Berezhkovskiy, W.S.Blair, C.Chang, J.Driscoll, C.Eigenbrot, N.Ghilardi, P.Gibbons, J.Halladay, A.Johnson, P.B.Kohli, Y.Lai, M.Liimatta, P.Mantik, K.Menghrajani, J.Murray, A.Sambrone, Y.Xiao, S.Shia, Y.Shin, J.Smith, S.Sohn, M.Stanley, M.Ultsch, B.Zhang, L.C.Wu, S.Magnuson.

ABSTRACT

No abstract given.