PDB entry 3bny

View 3bny on RCSB PDB site
Description: Crystal structure of aristolochene synthase complexed with 2-fluorofarnesyl diphosphate (2F-FPP)
Class: lyase
Keywords: sesquiterpene cyclase, isoprenoid, farnesyl diphosphate, magnesium, cyclization, LYASE
Deposited on 2007-12-14, released 2008-03-25
The last revision prior to the SCOPe 2.05 freeze date was dated 2009-02-24, with a file datestamp of 2009-03-01.
Experiment type: XRAY
Resolution: 1.89 Å
R-factor: 0.224
AEROSPACI score: 0.43 (click here for full SPACI score report)

Chains and heterogens:

  • Chain 'A':
    Compound: Aristolochene synthase
    Species: Aspergillus terreus [TaxId:33178]
    Gene: Ari1
    Database cross-references and differences (RAF-indexed): Domains in SCOPe 2.05: d3bnya_
  • Chain 'B':
    Compound: Aristolochene synthase
    Species: Aspergillus terreus [TaxId:33178]
    Gene: Ari1
    Database cross-references and differences (RAF-indexed): Domains in SCOPe 2.05: d3bnyb_
  • Chain 'C':
    Compound: Aristolochene synthase
    Species: Aspergillus terreus [TaxId:33178]
    Gene: Ari1
    Database cross-references and differences (RAF-indexed): Domains in SCOPe 2.05: d3bnyc_
  • Chain 'D':
    Compound: Aristolochene synthase
    Species: Aspergillus terreus [TaxId:33178]
    Gene: Ari1
    Database cross-references and differences (RAF-indexed): Domains in SCOPe 2.05: d3bnyd_
  • Heterogens: CL, MG, FPF, BME, HOH

PDB Chain Sequences:

  • Chain 'A':
    Sequence, based on SEQRES records: (download) 
    >3bnyA (A:)
mkkpngtngassslepppstfqplchplveevskevdgyflqhwnfpnekarkkfvaagf
srvtclyfpkalddrihfacrlltvlfliddlleymsfeegsayneklipisrgdvlpdr
sipveyiiydlwesmrahdremadeilepvflfmraqtdrtrarpmglggyleyrerdvg
kellaalmrfsmglklspselqrvreidancskhlsvvndiysyekelytsktahseggi
lctsvqilaqeadvtaeaakrvlfvmcrewelrhqllvarlsaegletpglaayvegley
qmsgnelwsqttlrysvvvd

    Sequence, based on observed residues (ATOM records): (download) 
    >3bnyA (A:)
slepppstfqplchplveevskevdgyflqhwnfpnekarkkfvaagfsrvtclyfpkal
ddrihfacrlltvlfliddlleymsfeegsayneklipisrgdvlpdrsipveyiiydlw
esmrahdremadeilepvflfmraqtdrtrarpmglggyleyrerdvgkellaalmrfsm
glklspselqrvreidancskhlsvvndiysyekelylctsvqilaqeadvtaeaakrvl
fvmcrewelrhqllvarlsaegletpglaayvegleyqmsgnelwsqttlrysv

  • Chain 'B':
    Sequence, based on SEQRES records: (download) 
    >3bnyB (B:)
mkkpngtngassslepppstfqplchplveevskevdgyflqhwnfpnekarkkfvaagf
srvtclyfpkalddrihfacrlltvlfliddlleymsfeegsayneklipisrgdvlpdr
sipveyiiydlwesmrahdremadeilepvflfmraqtdrtrarpmglggyleyrerdvg
kellaalmrfsmglklspselqrvreidancskhlsvvndiysyekelytsktahseggi
lctsvqilaqeadvtaeaakrvlfvmcrewelrhqllvarlsaegletpglaayvegley
qmsgnelwsqttlrysvvvd

    Sequence, based on observed residues (ATOM records): (download) 
    >3bnyB (B:)
slepppstfqplchplveevskevdgyflqhwnfpnekarkkfvaagfsrvtclyfpkal
ddrihfacrlltvlfliddlleymsfeegsayneklipisrgdvlpdrsipveyiiydlw
esmrahdremadeilepvflfmraqtdrtrarpmglggyleyrerdvgkellaalmrfsm
glklspselqrvreidancskhlsvvndiysyekelytilctsvqilaqeadvtaeaakr
vlfvmcrewelrhqllvarlsaegletpglaayvegleyqmsgnelwsqttlrysv

  • Chain 'C':
    Sequence, based on SEQRES records: (download) 
    >3bnyC (C:)
mkkpngtngassslepppstfqplchplveevskevdgyflqhwnfpnekarkkfvaagf
srvtclyfpkalddrihfacrlltvlfliddlleymsfeegsayneklipisrgdvlpdr
sipveyiiydlwesmrahdremadeilepvflfmraqtdrtrarpmglggyleyrerdvg
kellaalmrfsmglklspselqrvreidancskhlsvvndiysyekelytsktahseggi
lctsvqilaqeadvtaeaakrvlfvmcrewelrhqllvarlsaegletpglaayvegley
qmsgnelwsqttlrysvvvd

    Sequence, based on observed residues (ATOM records): (download) 
    >3bnyC (C:)
slepppstfqplchplveevskevdgyflqhwnfpnekarkkfvaagfsrvtclyfpkal
ddrihfacrlltvlfliddlleymsfeegsayneklipisrgdvlpdrsipveyiiydlw
esmrahdremadeilepvflfmraqtdrtrarpmglggyleyrerdvgkellaalmrfsm
glklspselqrvreidancskhlsvvndiysyekelytlctsvqilaqeadvtaeaakrv
lfvmcrewelrhqllvarlsaegtpglaayvegleyqmsgnelwsqttlrysv

  • Chain 'D':
    Sequence, based on SEQRES records: (download) 
    >3bnyD (D:)
mkkpngtngassslepppstfqplchplveevskevdgyflqhwnfpnekarkkfvaagf
srvtclyfpkalddrihfacrlltvlfliddlleymsfeegsayneklipisrgdvlpdr
sipveyiiydlwesmrahdremadeilepvflfmraqtdrtrarpmglggyleyrerdvg
kellaalmrfsmglklspselqrvreidancskhlsvvndiysyekelytsktahseggi
lctsvqilaqeadvtaeaakrvlfvmcrewelrhqllvarlsaegletpglaayvegley
qmsgnelwsqttlrysvvvd

    Sequence, based on observed residues (ATOM records): (download) 
    >3bnyD (D:)
slepppstfqplchplveevskevdgyflqhwnfpnekarkkfvaagfsrvtclyfpkal
ddrihfacrlltvlfliddlleymsfeegsayneklipisrgdvlpdrsipveyiiydlw
esmrahdremadeilepvflfmraqtdrtrarpmglggyleyrerdvgkellaalmrfsm
glklspselqrvreidancskhlsvvndiysyekelytsklctsvqilaqeadvtaeaak
rvlfvmcrewelrhqllvarlsaegletpglaayvegleyqmsgnelwsqttlrysv