PDB entry 5ita

View 5ita on RCSB PDB site
Description: Crystal Structure of BRAF Kinase Domain Bound to AZ-VEM
Class: transferase/transferase inhibitor
Keywords: transferase, kinase and inhibitor complex, TRANSFERASE-TRANSFERASE INHIBITOR complex
Deposited on 2016-03-16, released 2016-08-10
The last revision prior to the SCOPe 2.08 freeze date was dated 2016-08-10, with a file datestamp of 2016-08-05.
Experiment type: XRAY
Resolution: 1.95 Å
R-factor: N/A
AEROSPACI score: 0.33 (click here for full SPACI score report)

Chains and heterogens:

  • Chain 'A':
    Compound: Serine/threonine-protein kinase B-raf
    Species: Homo sapiens [TaxId:9606]
    Gene: BRAF, BRAF1, RAFB1
    Database cross-references and differences (RAF-indexed):
    • Uniprot P15056 (21-End)
      • engineered mutation (116-117)
      • engineered mutation (124)
      • engineered mutation (135)
      • engineered mutation (161)
      • engineered mutation (240)
      • engineered mutation (246)
      • engineered mutation (261)
      • engineered mutation (279)
      • engineered mutation (282)
      • engineered mutation (286)
      • engineered mutation (289)
    Domains in SCOPe 2.08: d5itaa_
  • Chain 'B':
    Compound: Serine/threonine-protein kinase B-raf
    Species: Homo sapiens [TaxId:9606]
    Gene: BRAF, BRAF1, RAFB1
    Database cross-references and differences (RAF-indexed):
    • Uniprot P15056 (21-End)
      • engineered mutation (116-117)
      • engineered mutation (124)
      • engineered mutation (135)
      • engineered mutation (161)
      • engineered mutation (203)
      • engineered mutation (240)
      • engineered mutation (246)
      • engineered mutation (261)
      • engineered mutation (279)
      • engineered mutation (282)
      • engineered mutation (286)
      • engineered mutation (289)
      • engineered mutation (293)
    Domains in SCOPe 2.08: d5itab_
  • Heterogens: 6DC, HOH

PDB Chain Sequences:

  • Chain 'A':
    Sequence, based on SEQRES records: (download)
    >5itaA (A:)
    mgsshhhhhhssglvprgshmddweipdgqitvgqrigsgsfgtvykgkwhgdvavkmln
    vtaptpqqlqafknevgvlrktrhvnillfmgystkpqlaivtqwcegsslyhhlhaset
    kfemkklidiarqtargmdylhaksiihrdlksnniflhedntvkigdfglatvksrwsg
    shqfeqlsgsilwmapevirmqdsnpysfqsdvyafgivlyelmtgqlpysninnrdqii
    emvgrgslspdlskvrsncpkrmkrlmaeclkkkrderpsfprilaeieelarelsg
    

    Sequence, based on observed residues (ATOM records): (download)
    >5itaA (A:)
    ddweipdgqitvgqrigsgsfgtvykgkwhgdvavkmlnvtaptpqqlqafknevgvlrk
    trhvnillfmgystkpqlaivtqwcegsslyhhlhasetkfemkklidiarqtargmdyl
    haksiihrdlksnniflhedntvkigdfglsilwmapevirmnpysfqsdvyafgivlye
    lmtgqlpysninnrdqiiemvgrgslspdlskvrsncpkrmkrlmaeclkkkrderpsfp
    rilaeieela
    

  • Chain 'B':
    Sequence, based on SEQRES records: (download)
    >5itaB (B:)
    mgsshhhhhhssglvprgshmddweipdgqitvgqrigsgsfgtvykgkwhgdvavkmln
    vtaptpqqlqafknevgvlrktrhvnillfmgystkpqlaivtqwcegsslyhhlhaset
    kfemkklidiarqtargmdylhaksiihrdlksnniflhedntvkigdfglatvksrwsg
    shqfeqlsgsilwmapevirmqdsnpysfqsdvyafgivlyelmtgqlpysninnrdqii
    emvgrgslspdlskvrsncpkrmkrlmaeclkkkrderpsfprilaeieelarelsg
    

    Sequence, based on observed residues (ATOM records): (download)
    >5itaB (B:)
    ddweipdgqitvgqrigsgtvykgkwhgdvavkmlnvtaptpqqlqafknevgvlrktrh
    vnillfmgystkpqlaivtqwcegsslyhhlhasetkfemkklidiarqtargmdylhak
    siihrdlksnniflhedntvkigdfsgsilwmapevirmqsnpysfqsdvyafgivlyel
    mtgqlpysninnrdqiiemvgrgslspdlskvrsncpkrmkrlmaeclkkkrderpsfpr
    ilaeieelarel