PDB entry 6io0

View 6io0 on RCSB PDB site
Description: Human IDH1 R132C mutant complexed with compound A.
Class: oxidoreductase
Keywords: iso-citrate dehydrogenase, allosteric inhibitor, nadph, oxidoreductase
Deposited on 2018-10-29, released 2019-10-30
The last revision prior to the SCOPe 2.08 freeze date was dated 2020-02-19, with a file datestamp of 2020-02-14.
Experiment type: XRAY
Resolution: 2.2 Å
R-factor: N/A
AEROSPACI score: 0.26 (click here for full SPACI score report)

Chains and heterogens:

  • Chain 'A':
    Compound: isocitrate dehydrogenase [nadp] cytoplasmic
    Species: Homo sapiens [TaxId:9606]
    Gene: IDH1, PICD
    Database cross-references and differences (RAF-indexed):
    • Uniprot O75874
      • engineered mutation (131)
    Domains in SCOPe 2.08: d6io0a_
  • Chain 'B':
    Compound: isocitrate dehydrogenase [nadp] cytoplasmic
    Species: Homo sapiens [TaxId:9606]
    Gene: IDH1, PICD
    Database cross-references and differences (RAF-indexed):
    • Uniprot O75874
      • engineered mutation (131)
    Domains in SCOPe 2.08: d6io0b_
  • Heterogens: AOU, NDP, CIT, GOL, HOH

PDB Chain Sequences:

  • Chain 'A':
    Sequence, based on SEQRES records: (download) 
    >6io0A (A:)
mskkisggsvvemqgdemtriiwelikeklifpyveldlhsydlgienrdatndqvtkda
aeaikkhnvgvkcatitpdekrveefklkqmwkspngtirnilggtvfreaiickniprl
vsgwvkpiiigchaygdqyratdfvvpgpgkveitytpsdgtqkvtylvhnfeegggvam
gmynqdksiedfahssfqmalskgwplylstkntilkkydgrfkdifqeiydkqyksqfe
aqkiwyehrliddmvaqamkseggfiwacknydgdvqsdsvaqgygslgmmtsvlvcpdg
ktveaeaahgtvtrhyrmyqkgqetstnpiasifawtrglahrakldnnkelaffanale
evsietieagfmtkdlaacikglpnvqrsdylntfefmdklgenlkiklaqakl

    Sequence, based on observed residues (ATOM records): (download) 
    >6io0A (A:)
kkisggsvvemqgdemtriiwelikeklifpyveldlhsydlgienrdatndqvtkdaae
aikkhnvgvkcatitpdekrveefklkqmwkspngtirnilggtvfreaiickniprlvs
gwvkpiiigchratdfvvpgpgkveitytpsdgtqkvtylvhnfeegggvamgmynqdks
iedfahssfqmalskgwplylstkntilkkydgrfkdifqeiydkqyksqfeaqkiwyeh
rliddmvaqamkseggfiwackvqsdsvaqgygslgmmtsvlvcpdgktveaeaahgtvt
rhyrmyqkgqetstnpiasifawtrglahrakldnnkelaffanaleevsietieagfmt
kdlaacikglpnvqrsdylntfefmdklgenlkiklaqak

  • Chain 'B':
    Sequence, based on SEQRES records: (download) 
    >6io0B (B:)
mskkisggsvvemqgdemtriiwelikeklifpyveldlhsydlgienrdatndqvtkda
aeaikkhnvgvkcatitpdekrveefklkqmwkspngtirnilggtvfreaiickniprl
vsgwvkpiiigchaygdqyratdfvvpgpgkveitytpsdgtqkvtylvhnfeegggvam
gmynqdksiedfahssfqmalskgwplylstkntilkkydgrfkdifqeiydkqyksqfe
aqkiwyehrliddmvaqamkseggfiwacknydgdvqsdsvaqgygslgmmtsvlvcpdg
ktveaeaahgtvtrhyrmyqkgqetstnpiasifawtrglahrakldnnkelaffanale
evsietieagfmtkdlaacikglpnvqrsdylntfefmdklgenlkiklaqakl

    Sequence, based on observed residues (ATOM records): (download) 
    >6io0B (B:)
kkisggsvvemqgdemtriiwelikeklifpyveldlhsydlgienrdatndqvtkdaae
aikkhnvgvkcatitpdekrveefklkqmwkspngtirnilggtvfreaiickniprlvs
gwvkpiiigchratdfvvpgpgkveitytpsdgtqkvtylvhnfeegggvamgmynqdks
iedfahssfqmalskgwplylstkntilkkydgrfkdifqeiydkqyksqfeaqkiwyeh
rliddmvaqamkseggfiwacknvqsdsvaqgygslgmmtsvlvcpdgktveaeaahgtv
trhyrmyqkgqetstnpiasifawtrglahrakldnnkelaffanaleevsietieagfm
tkdlaacikglpnvqrsdylntfefmdklgenlkiklaqa