PDB entry 2ij5

View 2ij5 on RCSB PDB site
Description: Crystal structure of cytochrome P450 CYP121, P212121 space group
Class: oxidoreductase
Keywords: tuberculosis, CYP121, cytochrome P450, azole ligation, fluconazole
Deposited on 2006-09-29, released 2006-11-07
The last revision prior to the SCOP 1.73 freeze date was dated 2007-05-08, with a file datestamp of 2007-06-04.
Experiment type: XRAY
Resolution: 1.6 Å
R-factor: 0.167
AEROSPACI score: 0.61 (click here for full SPACI score report)

Chains and heterogens:

  • Chain 'A':
    Compound: Cytochrome P450 121
    Species: Mycobacterium tuberculosis
    Gene: cyp121
    Database cross-references and differences (RAF-indexed): Domains in SCOP 1.73: d2ij5a1
  • Chain 'B':
    Compound: Cytochrome P450 121
    Species: Mycobacterium tuberculosis
    Gene: cyp121
    Database cross-references and differences (RAF-indexed): Domains in SCOP 1.73: d2ij5b1
  • Chain 'C':
    Compound: Cytochrome P450 121
    Species: Mycobacterium tuberculosis
    Gene: cyp121
    Database cross-references and differences (RAF-indexed): Domains in SCOP 1.73: d2ij5c1
  • Chain 'D':
    Compound: Cytochrome P450 121
    Species: Mycobacterium tuberculosis
    Gene: cyp121
    Database cross-references and differences (RAF-indexed): Domains in SCOP 1.73: d2ij5d1
  • Chain 'E':
    Compound: Cytochrome P450 121
    Species: Mycobacterium tuberculosis
    Gene: cyp121
    Database cross-references and differences (RAF-indexed): Domains in SCOP 1.73: d2ij5e1
  • Chain 'F':
    Compound: Cytochrome P450 121
    Species: Mycobacterium tuberculosis
    Gene: cyp121
    Database cross-references and differences (RAF-indexed): Domains in SCOP 1.73: d2ij5f1
  • Heterogens: SO4, HEM, HOH

PDB Chain Sequences:

  • Chain 'A':
    Sequence, based on SEQRES records: (download) 
    >2ij5A (A:)
mtatvllevpfsargdripdavaelrtrepirkvrtitgaeawlvssyalctqvledrrf
smketaaagaprlnaltvppevvnnmgniadaglrkavmkaitpkapgleqflrdtansl
ldnlitegapadlrndfadplatalhckvlgipqedgpklfrslsiafmssadpipaaki
nwdrdieymagilenpnittglmgelsrlrkdpayshvsdelfatigvtffgagvistgs
flttalisliqrpqlrnllhekpelipagveellrinlsfadglprlatadiqvgdvlvr
kgelvlvlleganfdpehfpnpgsieldrpnptshlafgrgqhfcpgsalgrrhaqigie
allkkmpgvdlavpidqlvwrtrfqrriperlpvlw

    Sequence, based on observed residues (ATOM records): (download) 
    >2ij5A (A:)
vllevpfsargdripdavaelrtrepirkvrtitgaeawlvssyalctqvledrrfsmke
taaagaprlnaltvppevvnnmgniadaglrkavmkaitpkapgleqflrdtanslldnl
itegapadlrndfadplatalhckvlgipqedgpklfrslsiafmssadpipaakinwdr
dieymagilenpnittglmgelsrlrkdpayshvsdelfatigvtffgagvistgsfltt
alisliqrpqlrnllhekpelipagveellrinlsfadglprlatadiqvgdvlvrkgel
vlvlleganfdpehfpnpgsieldrpnptshlafgrgqhfcpgsalgrrhaqigieallk
kmpgvdlavpidqlvwrtrfqrriperlpvlw

  • Chain 'B':
    Sequence, based on SEQRES records: (download) 
    >2ij5B (B:)
mtatvllevpfsargdripdavaelrtrepirkvrtitgaeawlvssyalctqvledrrf
smketaaagaprlnaltvppevvnnmgniadaglrkavmkaitpkapgleqflrdtansl
ldnlitegapadlrndfadplatalhckvlgipqedgpklfrslsiafmssadpipaaki
nwdrdieymagilenpnittglmgelsrlrkdpayshvsdelfatigvtffgagvistgs
flttalisliqrpqlrnllhekpelipagveellrinlsfadglprlatadiqvgdvlvr
kgelvlvlleganfdpehfpnpgsieldrpnptshlafgrgqhfcpgsalgrrhaqigie
allkkmpgvdlavpidqlvwrtrfqrriperlpvlw

    Sequence, based on observed residues (ATOM records): (download) 
    >2ij5B (B:)
tvllevpfsargdripdavaelrtrepirkvrtitgaeawlvssyalctqvledrrfsmk
etaaagaprlnaltvppevvnnmgniadaglrkavmkaitpkapgleqflrdtanslldn
litegapadlrndfadplatalhckvlgipqedgpklfrslsiafmssadpipaakinwd
rdieymagilenpnittglmgelsrlrayshvsdelfatigvtffgagvistgsflttal
isliqrpqlrnllhekpelipagveellrinlsfadglprlatadiqvgdvlvrkgelvl
vlleganfdpehfpnpgsieldrpnptshlafgrgqhfcpgsalgrrhaqigieallkkm
pgvdlavpidqlvwrtrfqrriperlpvlw

  • Chain 'C':
    Sequence, based on SEQRES records: (download) 
    >2ij5C (C:)
mtatvllevpfsargdripdavaelrtrepirkvrtitgaeawlvssyalctqvledrrf
smketaaagaprlnaltvppevvnnmgniadaglrkavmkaitpkapgleqflrdtansl
ldnlitegapadlrndfadplatalhckvlgipqedgpklfrslsiafmssadpipaaki
nwdrdieymagilenpnittglmgelsrlrkdpayshvsdelfatigvtffgagvistgs
flttalisliqrpqlrnllhekpelipagveellrinlsfadglprlatadiqvgdvlvr
kgelvlvlleganfdpehfpnpgsieldrpnptshlafgrgqhfcpgsalgrrhaqigie
allkkmpgvdlavpidqlvwrtrfqrriperlpvlw

    Sequence, based on observed residues (ATOM records): (download) 
    >2ij5C (C:)
atvllevpfsargdripdavaelrtrepirkvrtitgaeawlvssyalctqvledrrfsm
ketaaagaprlnaltvppevvnnmgniadaglrkavmkaitpkapgleqflrdtanslld
nlitegapadlrndfadplatalhckvlgipqedgpklfrslsiafmssadpipaakinw
drdieymagilenpnittglmgelsrlrkdpayshvsdelfatigvtffgagvistgsfl
ttalisliqrpqlrnllhekpelipagveellrinlsfadglprlatadiqvgdvlvrkg
elvlvlleganfdpehfpnpgsieldrpnptshlafgrgqhfcpgsalgrrhaqigieal
lkkmpgvdlavpidqlvwrtrfqrriperlpvlw

  • Chain 'D':
    Sequence, based on SEQRES records: (download) 
    >2ij5D (D:)
mtatvllevpfsargdripdavaelrtrepirkvrtitgaeawlvssyalctqvledrrf
smketaaagaprlnaltvppevvnnmgniadaglrkavmkaitpkapgleqflrdtansl
ldnlitegapadlrndfadplatalhckvlgipqedgpklfrslsiafmssadpipaaki
nwdrdieymagilenpnittglmgelsrlrkdpayshvsdelfatigvtffgagvistgs
flttalisliqrpqlrnllhekpelipagveellrinlsfadglprlatadiqvgdvlvr
kgelvlvlleganfdpehfpnpgsieldrpnptshlafgrgqhfcpgsalgrrhaqigie
allkkmpgvdlavpidqlvwrtrfqrriperlpvlw

    Sequence, based on observed residues (ATOM records): (download) 
    >2ij5D (D:)
llevpfsargdripdavaelrtrepirkvrtitgaeawlvssyalctqvledrrfsmket
aaagaprlnaltvppevvnnmgniadaglrkavmkaitpkapgleqflrdtanslldnli
tegapadlrndfadplatalhckvlgipqedgpklfrslsiafmssadpipaakinwdrd
ieymagilenpnittglmgelsrlrkdpayshvsdelfatigvtffgagvistgsfltta
lisliqrpqlrnllhekpelipagveellrinlsfadglprlatadiqvgdvlvrkgelv
lvlleganfdpehfpnpgsieldrpnptshlafgrgqhfcpgsalgrrhaqigieallkk
mpgvdlavpidqlvwrtrfqrriperlpvlw

  • Chain 'E':
    Sequence, based on SEQRES records: (download) 
    >2ij5E (E:)
mtatvllevpfsargdripdavaelrtrepirkvrtitgaeawlvssyalctqvledrrf
smketaaagaprlnaltvppevvnnmgniadaglrkavmkaitpkapgleqflrdtansl
ldnlitegapadlrndfadplatalhckvlgipqedgpklfrslsiafmssadpipaaki
nwdrdieymagilenpnittglmgelsrlrkdpayshvsdelfatigvtffgagvistgs
flttalisliqrpqlrnllhekpelipagveellrinlsfadglprlatadiqvgdvlvr
kgelvlvlleganfdpehfpnpgsieldrpnptshlafgrgqhfcpgsalgrrhaqigie
allkkmpgvdlavpidqlvwrtrfqrriperlpvlw

    Sequence, based on observed residues (ATOM records): (download) 
    >2ij5E (E:)
tvllevpfsargdripdavaelrtrepirkvrtitgaeawlvssyalctqvledrrfsmk
etaaagaprlnaltvppevvnnmgniadaglrkavmkaileqflrdtanslldnlitega
padlrndfadplatalhckvlgipqedgpklfrslsiafmssadpipaakinwdrdieym
agilenpnittglmgelsrlrkdpayshvsdelfatigvtffgagvistgsflttalisl
iqrpqlrnllhekpelipagveellrinlsfadglprlatadiqvgdvlvrkgelvlvll
eganfdpehfpnpgsieldrpnptshlafgrgqhfcpgsalgrrhaqigieallkkmpgv
dlavpidqlvwrtrfqrriperlpvlw

  • Chain 'F':
    Sequence, based on SEQRES records: (download) 
    >2ij5F (F:)
mtatvllevpfsargdripdavaelrtrepirkvrtitgaeawlvssyalctqvledrrf
smketaaagaprlnaltvppevvnnmgniadaglrkavmkaitpkapgleqflrdtansl
ldnlitegapadlrndfadplatalhckvlgipqedgpklfrslsiafmssadpipaaki
nwdrdieymagilenpnittglmgelsrlrkdpayshvsdelfatigvtffgagvistgs
flttalisliqrpqlrnllhekpelipagveellrinlsfadglprlatadiqvgdvlvr
kgelvlvlleganfdpehfpnpgsieldrpnptshlafgrgqhfcpgsalgrrhaqigie
allkkmpgvdlavpidqlvwrtrfqrriperlpvlw

    Sequence, based on observed residues (ATOM records): (download) 
    >2ij5F (F:)
llevpfsargdripdavaelrtrepirkvrtitgaeawlvssyalctqvledrrfsmket
aaagaprlnaltvppevvnnmgniadaglrkavmkaitpkaleqflrdtanslldnlite
gapadlrndfadplatalhckvlgipqedgpklfrslsiafmssadpipaakinwdrdie
ymagilenpnittglmgelsrlrshvsdelfatigvtffgagvistgsflttalisliqr
pqlrnllhekpelipagveellrinlsfadglprlatadiqvgdvlvrkgelvlvllega
nfdpehfpnpgsieldrpnptshlafgrgqhfcpgsalgrrhaqigieallkkmpgvdla
vpidqlvwrtrfqrriperlpvlw