PDB entry 3w1f

View 3w1f on RCSB PDB site
Description: Crystal structure of Human MPS1 catalytic domain in complex with 5-(5-ethoxy-6-(1-methyl-1H-pyrazol-4-yl)-1H-indazol-3-yl)-2-methylbenzenesulfonamide
Class: transferase/transferase inhibitor
Keywords: KINASE, SERINE/THREONINE-PROTEIN KINASE, TRANSFERASE-TRANSFERASE INHIBITOR complex
Deposited on 2012-11-14, released 2013-06-26
The last revision prior to the SCOPe 2.05 freeze date was dated 2014-04-30, with a file datestamp of 2014-04-25.
Experiment type: XRAY
Resolution: 2.7 Å
R-factor: 0.237
AEROSPACI score: 0.18 (click here for full SPACI score report)

Chains and heterogens:

  • Chain 'A':
    Compound: Dual specificity protein kinase TTK
    Species: Homo sapiens [TaxId:9606]
    Gene: TTK, MPS1, MPS1L1
    Database cross-references and differences (RAF-indexed): Domains in SCOPe 2.05: d3w1fa_
  • Heterogens: 1O5, HOH

PDB Chain Sequences:

  • Chain 'A':
    Sequence, based on SEQRES records: (download)
    >3w1fA (A:)
    mecisvkgriysilkqigsggsskvfqvlnekkqiyaikyvnleeadnqtldsyrneiay
    lnklqqhsdkiirlydyeitdqyiymvmecgnidlnswlkkkksidpwerksywknmlea
    vhtihqhgivhsdlkpanflivdgmlklidfgianqmqpdttsvvkdsqvgtvnymppea
    ikdmsssrengkskskispksdvwslgcilyymtygktpfqqiinqisklhaiidpnhei
    efpdipekdlqdvlkcclkrdpkqrisipellahpyvqiqthpvnqmakgtteemkyvlg
    qlvglnlvprgsaaghhhhhh
    

    Sequence, based on observed residues (ATOM records): (download)
    >3w1fA (A:)
    ecisvkgriysilkqigsggsskvfqvlnekkqiyaikyvnleeadnqtldsyrneiayl
    nklqqhsdkiirlydyeitdqyiymvmecgnidlnswlkkkksidpwerksywknmleav
    htihqhgivhsdlkpanflivdgmlklidfgianqmqpdgtvnymppeaikdmsispksd
    vwslgcilyymtygktpfqqiinqisklhaiidpnheiefpdipekdlqdvlkcclkrdp
    kqrisipellahpyvqiqt