PDB entry 1rww

View 1rww on RCSB PDB site
Description: Crystal structure of human caspase-1 in complex with 4-oxo-3-[(6-{[4-(quinoxalin-2-ylamino)-benzoylamino]-methyl}-pyridine-3-carbonyl)-amino]-butyric acid
Class: hydrolase
Keywords: protein-small molecule inhibitor complex, HYDROLASE
Deposited on 2003-12-17, released 2004-12-28
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: 2.8 Å
R-factor: 0.193
AEROSPACI score: 0.28 (click here for full SPACI score report)

Chains and heterogens:

  • Chain 'A':
    Compound: Interleukin-1 beta convertase
    Species: Homo sapiens [TaxId:9606]
    Gene: CASP1, IL1BC, IL1BCE
    Database cross-references and differences (RAF-indexed): Domains in SCOPe 2.08: d1rww.1
  • Chain 'B':
    Compound: Interleukin-1 beta convertase
    Species: Homo sapiens [TaxId:9606]
    Gene: CASP1, IL1BC, IL1BCE
    Database cross-references and differences (RAF-indexed): Domains in SCOPe 2.08: d1rww.1
  • Heterogens: OQB, HOH

PDB Chain Sequences:

  • Chain 'A':
    Sequence, based on SEQRES records: (download) 
    >1rwwA (A:)
npamptssgsegnvklcsleeaqriwkqksaeiypimdkssrtrlaliicneefdsiprr
tgaevditgmtmllqnlgysvdvkknltasdmtteleafahrpehktsdstflvfmshgi
regicgkkhseqvpdilqlnaifnmlntkncpslkdkpkviiiqacrgdspgvvwfkd

    Sequence, based on observed residues (ATOM records): (download) 
    >1rwwA (A:)
mptssgsegnvklcsleeaqriwkqksaeiypimdkssrtrlaliicneefdsiprrtga
evditgmtmllqnlgysvdvkknltasdmtteleafahrpehktsdstflvfmshgireg
icgkkhseqvpdilqlnaifnmlntkncpslkdkpkviiiqacrgdspgvvwfkd

  • Chain 'B':
    Sequence; same for both SEQRES and ATOM records: (download) 
    >1rwwB (B:)
aikkahiekdfiafcsstpdnvswrhptmgsvfigrliehmqeyacscdveeifrkvrfs
feqpdgraqmpttervtltrcfylfpgh