PDB entry 6rsh

View 6rsh on RCSB PDB site
Description: Structure based optimization of JAK1-ATP binding pocket Inhibitors in the aminopyrazole class
Class: transferase
Keywords: Inhibitor, Complex, TRANSFERASE
Deposited on 2019-05-21, released 2020-07-08
The last revision prior to the SCOPe 2.08 freeze date was dated 2020-07-08, with a file datestamp of 2020-07-03.
Experiment type: XRAY
Resolution: 1.71 Å
R-factor: N/A
AEROSPACI score: 0.39 (click here for full SPACI score report)

Chains and heterogens:

  • Chain 'A':
    Compound: Tyrosine-protein kinase JAK1
    Species: Homo sapiens [TaxId:9606]
    Gene: JAK1, JAK1A, JAK1B
    Database cross-references and differences (RAF-indexed): Domains in SCOPe 2.08: d6rsha_
  • Chain 'B':
    Compound: Tyrosine-protein kinase JAK1
    Species: Homo sapiens [TaxId:9606]
    Gene: JAK1, JAK1A, JAK1B
    Database cross-references and differences (RAF-indexed): Domains in SCOPe 2.08: d6rshb_
  • Heterogens: KHE, HOH

PDB Chain Sequences:

  • Chain 'A':
    Sequence, based on SEQRES records: (download)
    >6rshA (A:)
    gdivsekkpatevdpthfekrflkrirdlgeghfgkvelcrydpegdntgeqvavkslkp
    esggnhiadlkkeieilrnlyhenivkykgictedggngiklimeflpsgslkeylpknk
    nkinlkqqlkyavqickgmdylgsrqyvhrdlaarnvlvesehqvkigdfgltkaietdk
    eyytvkddrdspvfwyapeclmqskfyiasdvwsfgvtlhelltycdsdsspmalflkmi
    gpthgqmtvtrlvntlkegkrlpcppncpdevyqlmrkcwefqpsnrtsfqnliegfeal
    lk
    

    Sequence, based on observed residues (ATOM records): (download)
    >6rshA (A:)
    vdpthfekrflkrirdlgeghfgkvelcrydpegdntgeqvavkslkpesggnhiadlkk
    eieilrnlyhenivkykgictegiklimeflpsgslkeylpknknkinlkqqlkyavqic
    kgmdylgsrqyvhrdlaarnvlvesehqvkigdfgltkaietdkeyytvkddrdspvfwy
    apeclmqskfyiasdvwsfgvtlhelltycdsdsspmalflkmigpthgqmtvtrlvntl
    kegkrlpcppncpdevyqlmrkcwefqpsnrtsfqnliegfeallk
    

  • Chain 'B':
    Sequence, based on SEQRES records: (download)
    >6rshB (B:)
    gdivsekkpatevdpthfekrflkrirdlgeghfgkvelcrydpegdntgeqvavkslkp
    esggnhiadlkkeieilrnlyhenivkykgictedggngiklimeflpsgslkeylpknk
    nkinlkqqlkyavqickgmdylgsrqyvhrdlaarnvlvesehqvkigdfgltkaietdk
    eyytvkddrdspvfwyapeclmqskfyiasdvwsfgvtlhelltycdsdsspmalflkmi
    gpthgqmtvtrlvntlkegkrlpcppncpdevyqlmrkcwefqpsnrtsfqnliegfeal
    lk
    

    Sequence, based on observed residues (ATOM records): (download)
    >6rshB (B:)
    vdpthfekrflkrirdlgeghfgkvelcrydpegdntgeqvavkslkphiadlkkeieil
    rnlyhenivkykgictegiklimeflpsgslkeylpknknkinlkqqlkyavqickgmdy
    lgsrqyvhrdlaarnvlvesehqvkigdfgltkaietdkeyytvkddrdspvfwyapecl
    mqskfyiasdvwsfgvtlhelltycdsdsspmalflkmigpthgqmtvtrlvntlkegkr
    lpcppncpdevyqlmrkcwefqpsnrtsfqnliegfeallk