PDB entry 3khj

View 3khj on RCSB PDB site
Description: C. parvum inosine monophosphate dehydrogenase bound by inhibitor C64
Class: oxidoreductase
Keywords: enzyme-inhibitor complex, Oxidoreductase
Deposited on 2009-10-30, released 2010-02-02
The last revision prior to the SCOPe 2.03 freeze date was dated 2011-01-19, with a file datestamp of 2011-01-14.
Experiment type: XRAY
Resolution: 2.8 Å
R-factor: 0.226
AEROSPACI score: 0.25 (click here for full SPACI score report)

Chains and heterogens:

  • Chain 'A':
    Compound: Inosine-5-monophosphate dehydrogenase
    Species: Cryptosporidium parvum [TaxId:353152]
    Gene: cgd6_20, GuaB
    Database cross-references and differences (RAF-indexed):
    • Uniprot Q5CPK7 (Start-91)
      • linker (92-94)
    • Uniprot Q5CPK7 (95-End)
    Domains in SCOPe 2.03: d3khja_
  • Chain 'B':
    Compound: Inosine-5-monophosphate dehydrogenase
    Species: Cryptosporidium parvum [TaxId:353152]
    Gene: cgd6_20, GuaB
    Database cross-references and differences (RAF-indexed):
    • Uniprot Q5CPK7 (Start-91)
      • linker (92-94)
    • Uniprot Q5CPK7 (95-End)
    Domains in SCOPe 2.03: d3khjb_
  • Chain 'C':
    Compound: Inosine-5-monophosphate dehydrogenase
    Species: Cryptosporidium parvum [TaxId:353152]
    Gene: cgd6_20, GuaB
    Database cross-references and differences (RAF-indexed):
    • Uniprot Q5CPK7 (Start-91)
      • linker (92-94)
    • Uniprot Q5CPK7 (95-End)
    Domains in SCOPe 2.03: d3khjc_
  • Chain 'D':
    Compound: Inosine-5-monophosphate dehydrogenase
    Species: Cryptosporidium parvum [TaxId:353152]
    Gene: cgd6_20, GuaB
    Database cross-references and differences (RAF-indexed):
    • Uniprot Q5CPK7 (3-91)
      • linker (92-94)
    • Uniprot Q5CPK7 (95-End)
    Domains in SCOPe 2.03: d3khjd_
  • Chain 'E':
    Compound: Inosine-5-monophosphate dehydrogenase
    Species: Cryptosporidium parvum [TaxId:353152]
    Gene: cgd6_20, GuaB
    Database cross-references and differences (RAF-indexed):
    • Uniprot Q5CPK7 (Start-91)
      • linker (92-94)
    • Uniprot Q5CPK7 (95-End)
    Domains in SCOPe 2.03: d3khje_
  • Chain 'F':
    Compound: Inosine-5-monophosphate dehydrogenase
    Species: Cryptosporidium parvum [TaxId:353152]
    Gene: cgd6_20, GuaB
    Database cross-references and differences (RAF-indexed):
    • Uniprot Q5CPK7 (Start-91)
      • linker (92-94)
    • Uniprot Q5CPK7 (95-End)
    Domains in SCOPe 2.03: d3khjf_
  • Chain 'G':
    Compound: Inosine-5-monophosphate dehydrogenase
    Species: Cryptosporidium parvum [TaxId:353152]
    Gene: cgd6_20, GuaB
    Database cross-references and differences (RAF-indexed):
    • Uniprot Q5CPK7 (Start-91)
      • linker (92-94)
    • Uniprot Q5CPK7 (95-End)
    Domains in SCOPe 2.03: d3khjg_
  • Chain 'H':
    Compound: Inosine-5-monophosphate dehydrogenase
    Species: Cryptosporidium parvum [TaxId:353152]
    Gene: cgd6_20, GuaB
    Database cross-references and differences (RAF-indexed):
    • Uniprot Q5CPK7 (Start-91)
      • linker (92-94)
    • Uniprot Q5CPK7 (95-End)
    Domains in SCOPe 2.03: d3khjh_
  • Heterogens: IMP, C64, ACT, HOH

PDB Chain Sequences:

  • Chain 'A':
    Sequence, based on SEQRES records: (download) 
    >3khjA (A:)
gshmgtknigkgltfedillvpnysevlprevsletkltknvslkiplissamdtvtehl
mavgmarlggigiihknmdmesqvnevlkvknsgglrvgaaigvneierakllveagvdv
ivldsahghslniirtlkeikskmnidvivgnvvteeatkeliengadgikvgigpgsic
ttrivagvgvpqitaiekcssvaskfgipiiadggirysgdigkalavgassvmigsila
gteespgekeligdtvykyyrgmgsvgamksgsgdryfqekrpenkmvpegiegrvkykg
emegvvyqlvgglrscmgylgsasieelwkkssyveittsglreshvhdveivkevmnys
k

    Sequence, based on observed residues (ATOM records): (download) 
    >3khjA (A:)
tknigkgltfedillvpnysevlprevsletkltknvslkiplissamdtvtehlmavgm
arlggigiihknmdmesqvnevlkvknsgglrvgaaigvneierakllveagvdvivlds
ahghslniirtlkeikskmnidvivgnvvteeatkeliengadgikvgigpgsicttriv
agvgvpqitaiekcssvaskfgipiiadggirysgdigkalavgassvmigsilagtees
pgekeligdtvykyygrvkykgemegvvyqlvgglrscmgylgsasieelwkkssyveit
ts

  • Chain 'B':
    Sequence, based on SEQRES records: (download) 
    >3khjB (B:)
gshmgtknigkgltfedillvpnysevlprevsletkltknvslkiplissamdtvtehl
mavgmarlggigiihknmdmesqvnevlkvknsgglrvgaaigvneierakllveagvdv
ivldsahghslniirtlkeikskmnidvivgnvvteeatkeliengadgikvgigpgsic
ttrivagvgvpqitaiekcssvaskfgipiiadggirysgdigkalavgassvmigsila
gteespgekeligdtvykyyrgmgsvgamksgsgdryfqekrpenkmvpegiegrvkykg
emegvvyqlvgglrscmgylgsasieelwkkssyveittsglreshvhdveivkevmnys
k

    Sequence, based on observed residues (ATOM records): (download) 
    >3khjB (B:)
tknigkgltfedillvpnysevlprevsletkltknvslkiplissamdtvtehlmavgm
arlggigiihknmdmesqvnevlkvknsgglrvgaaigvneierakllveagvdvivlds
ahghslniirtlkeikskmnidvivgnvvteeatkeliengadgikvgigpgsicttriv
agvgvpqitaiekcssvaskfgipiiadggirysgdigkalavgassvmigsilagtees
pgekeligdtvykyyrgmgsvgamkmvpegiegrvkykgemegvvyqlvgglrscmgylg
sasieelwkkssyveitt

  • Chain 'C':
    Sequence, based on SEQRES records: (download) 
    >3khjC (C:)
gshmgtknigkgltfedillvpnysevlprevsletkltknvslkiplissamdtvtehl
mavgmarlggigiihknmdmesqvnevlkvknsgglrvgaaigvneierakllveagvdv
ivldsahghslniirtlkeikskmnidvivgnvvteeatkeliengadgikvgigpgsic
ttrivagvgvpqitaiekcssvaskfgipiiadggirysgdigkalavgassvmigsila
gteespgekeligdtvykyyrgmgsvgamksgsgdryfqekrpenkmvpegiegrvkykg
emegvvyqlvgglrscmgylgsasieelwkkssyveittsglreshvhdveivkevmnys
k

    Sequence, based on observed residues (ATOM records): (download) 
    >3khjC (C:)
tknigkgltfedillvpnysevlprevsletkltknvslkiplissamdtvtehlmavgm
arlggigiihknmdmesqvnevlkvknsgglrvgaaigvneierakllveagvdvivlds
ahghslniirtlkeikskmnidvivgnvvteeatkeliengadgikvgigpgsicttriv
agvgvpqitaiekcssvaskfgipiiadggirysgdigkalavgassvmigsilagtees
pgekeligdtvykyyrgiegrvkykgemegvvyqlvgglrscmgylgsasieelwkkssy
veitts

  • Chain 'D':
    Sequence, based on SEQRES records: (download) 
    >3khjD (D:)
gshmgtknigkgltfedillvpnysevlprevsletkltknvslkiplissamdtvtehl
mavgmarlggigiihknmdmesqvnevlkvknsgglrvgaaigvneierakllveagvdv
ivldsahghslniirtlkeikskmnidvivgnvvteeatkeliengadgikvgigpgsic
ttrivagvgvpqitaiekcssvaskfgipiiadggirysgdigkalavgassvmigsila
gteespgekeligdtvykyyrgmgsvgamksgsgdryfqekrpenkmvpegiegrvkykg
emegvvyqlvgglrscmgylgsasieelwkkssyveittsglreshvhdveivkevmnys
k

    Sequence, based on observed residues (ATOM records): (download) 
    >3khjD (D:)
mgtknigkgltfedillvpnysevlprevsletkltknvslkiplissamdtvtehlmav
gmarlggigiihknmdmesqvnevlkvknsgglrvgaaigvneierakllveagvdvivl
dsahghslniirtlkeikskmnidvivgnvvteeatkeliengadgikvgigpgsicttr
ivagvgvpqitaiekcssvaskfgipiiadggirysgdigkalavgassvmigsilagte
espgekeligdtvykyyrgmgsvgamksmvpegiegrvkykgemegvvyqlvgglrscmg
ylgsasieelwkkssyveitt

  • Chain 'E':
    Sequence, based on SEQRES records: (download) 
    >3khjE (E:)
gshmgtknigkgltfedillvpnysevlprevsletkltknvslkiplissamdtvtehl
mavgmarlggigiihknmdmesqvnevlkvknsgglrvgaaigvneierakllveagvdv
ivldsahghslniirtlkeikskmnidvivgnvvteeatkeliengadgikvgigpgsic
ttrivagvgvpqitaiekcssvaskfgipiiadggirysgdigkalavgassvmigsila
gteespgekeligdtvykyyrgmgsvgamksgsgdryfqekrpenkmvpegiegrvkykg
emegvvyqlvgglrscmgylgsasieelwkkssyveittsglreshvhdveivkevmnys
k

    Sequence, based on observed residues (ATOM records): (download) 
    >3khjE (E:)
gtknigkgltfedillvpnysevlprevsletkltknvslkiplissamdtvtehlmavg
marlggigiihknmdmesqvnevlkvknsgglrvgaaigvneierakllveagvdvivld
sahghslniirtlkeikskmnidvivgnvvteeatkeliengadgikvgigpcttrivag
vgvpqitaiekcssvaskfgipiiadggirysgdigkalavgassvmigsilagteespg
ekeligdtvykyrvkykgemegvvyqlvgglrscmgylgsasieelwkkssyveitts

  • Chain 'F':
    Sequence, based on SEQRES records: (download) 
    >3khjF (F:)
gshmgtknigkgltfedillvpnysevlprevsletkltknvslkiplissamdtvtehl
mavgmarlggigiihknmdmesqvnevlkvknsgglrvgaaigvneierakllveagvdv
ivldsahghslniirtlkeikskmnidvivgnvvteeatkeliengadgikvgigpgsic
ttrivagvgvpqitaiekcssvaskfgipiiadggirysgdigkalavgassvmigsila
gteespgekeligdtvykyyrgmgsvgamksgsgdryfqekrpenkmvpegiegrvkykg
emegvvyqlvgglrscmgylgsasieelwkkssyveittsglreshvhdveivkevmnys
k

    Sequence, based on observed residues (ATOM records): (download) 
    >3khjF (F:)
tknigkgltfedillvpnysevlprevsletkltknvslkiplissamdtvtehlmavgm
arlggigiihknmdmesqvnevlkvknsgglrvgaaigvneierakllveagvdvivlds
ahghslniirtlkeikskmnidvivgnvvteeatkeliengadgikvgigpgsicttriv
agvgvpqitaiekcssvaskfgipiiadggirysgdigkalavgassvmigsilagtees
pgekeligdtvykyyrvkykgemegvvyqlvgglrscmgylgsasieelwkkssyveitt

  • Chain 'G':
    Sequence, based on SEQRES records: (download) 
    >3khjG (G:)
gshmgtknigkgltfedillvpnysevlprevsletkltknvslkiplissamdtvtehl
mavgmarlggigiihknmdmesqvnevlkvknsgglrvgaaigvneierakllveagvdv
ivldsahghslniirtlkeikskmnidvivgnvvteeatkeliengadgikvgigpgsic
ttrivagvgvpqitaiekcssvaskfgipiiadggirysgdigkalavgassvmigsila
gteespgekeligdtvykyyrgmgsvgamksgsgdryfqekrpenkmvpegiegrvkykg
emegvvyqlvgglrscmgylgsasieelwkkssyveittsglreshvhdveivkevmnys
k

    Sequence, based on observed residues (ATOM records): (download) 
    >3khjG (G:)
tknigkgltfedillvpnysevlprevsletkltknvslkiplissamdtvtehlmavgm
arlggigiihknmdmesqvnevlkvknsgglrvgaaigvneierakllveagvdvivlds
ahghslniirtlkeikskmnidvivgnvvteeatkeliengadgikvgigpgttrivagv
gvpqitaiekcssvaskfgipiiadggirysgdigkalavgassvmigsilagteespge
keligdtvykyyegrvkykgemegvvyqlvgglrscmgylgsasieelwkkssyveitts

  • Chain 'H':
    Sequence, based on SEQRES records: (download) 
    >3khjH (H:)
gshmgtknigkgltfedillvpnysevlprevsletkltknvslkiplissamdtvtehl
mavgmarlggigiihknmdmesqvnevlkvknsgglrvgaaigvneierakllveagvdv
ivldsahghslniirtlkeikskmnidvivgnvvteeatkeliengadgikvgigpgsic
ttrivagvgvpqitaiekcssvaskfgipiiadggirysgdigkalavgassvmigsila
gteespgekeligdtvykyyrgmgsvgamksgsgdryfqekrpenkmvpegiegrvkykg
emegvvyqlvgglrscmgylgsasieelwkkssyveittsglreshvhdveivkevmnys
k

    Sequence, based on observed residues (ATOM records): (download) 
    >3khjH (H:)
tknigkgltfedillvpnysevlprevsletkltknvslkiplissamdtvtehlmavgm
arlggigiihknmdmesqvnevlkvknsgglrvgaaigvneierakllveagvdvivlds
ahghslniirtlkeikskmnidvivgnvvteeatkeliengadgikvgigpgsicttriv
agvgvpqitaiekcssvaskfgipiiadggirysgdigkalavgassvmigsilagtees
pgekeligdtvykyyrgmgsvgamksgsgdryfqemvpegiegrvkykgemegvvyqlvg
glrscmgylgsasieelwkkssyveitt