PDB entry 3mj2
View 3mj2 on RCSB PDB site
Description: X-ray crystal structure of ITK complexed with inhibitor BMS-509744
Class: Transferase
Keywords: helix C-out, substrate blocking activation loop conformation, Transferase
Deposited on
2010-04-12, released
2010-06-30
The last revision prior to the SCOPe 2.08 freeze date was dated
2011-07-13, with a file datestamp of
2011-05-08.
Experiment type: XRAY
Resolution: 1.9 Å
R-factor: 0.208
AEROSPACI score: 0.45
(click here for full SPACI score report)
Chains and heterogens:
- Chain 'A':
Compound: Tyrosine-protein kinase ITK/TSK
Species: Homo sapiens [TaxId:9606]
Gene: ITK, EMT, LYK
Database cross-references and differences (RAF-indexed):
- Uniprot Q08881 (2-End)
- engineered (122)
- engineered (259)
Domains in SCOPe 2.08: d3mj2a_ - Heterogens: MJG, HOH
PDB Chain Sequences:
- Chain 'A':
Sequence, based on SEQRES records: (download)
>3mj2A (A:)
gsvidpseltfvqeigsgqfglvhlgywlnkdkvaiktiregamseedfieeaevmmkls
hpklvqlygvcleqapiclvfefmehgclsdylrtqrglfaaetllgmcldvcegmayle
easvihrdlaarnclvgenqvikvsdfgmtrfvlddqytsstgtkfpvkwaspevfsfsr
yssksdvwsfgvlmwevfsegkipyenrsnsevvedistgfrlykprlasthvyqimnhc
wkerpedrpafsrllrqlaaiaasgl
Sequence, based on observed residues (ATOM records): (download)
>3mj2A (A:)
vidpseltfvqeigsgqfglvhlgywlnkdkvaiktiregamseedfieeaevmmklshp
klvqlygvcleqapiclvfefmehgclsdylrtqrglfaaetllgmcldvcegmayleea
svihrdlaarnclvgenqvikvsdfgmtrfvlddqytsstgtkfpvkwaspevfsfsrys
sksdvwsfgvlmwevfsegkipyenrsnsevvedistgfrlykprlasthvyqimnhcwk
erpedrpafsrllrqlaai