PDB entry 1j3i

View 1j3i on RCSB PDB site
Description: Wild-type Plasmodium falciparum dihydrofolate reductase-thymidylate synthase (PfDHFR-TS) complexed with WR99210, NADPH, and dUMP
Class: oxidoreductase, transferase
Keywords: bifunctional, OXIDOREDUCTASE, TRANSFERASE
Deposited on 2003-02-03, released 2003-05-06
The last revision prior to the SCOPe 2.08 freeze date was dated 2009-02-24, with a file datestamp of 2009-03-01.
Experiment type: XRAY
Resolution: 2.33 Å
R-factor: 0.185
AEROSPACI score: 0.36 (click here for full SPACI score report)

Chains and heterogens:

  • Chain 'A':
    Compound: Bifunctional dihydrofolate reductase-thymidylate synthase
    Species: Plasmodium falciparum [TaxId:5833]
    Database cross-references and differences (RAF-indexed):
    • Uniprot P13922 (0-End)
      • see remark 999 (58)
      • see remark 999 (107)
    Domains in SCOPe 2.08: d1j3ia_
  • Chain 'B':
    Compound: Bifunctional dihydrofolate reductase-thymidylate synthase
    Species: Plasmodium falciparum [TaxId:5833]
    Database cross-references and differences (RAF-indexed):
    • Uniprot P13922
      • see remark 999 (58)
      • see remark 999 (107)
    Domains in SCOPe 2.08: d1j3ib_
  • Chain 'C':
    Compound: Bifunctional dihydrofolate reductase-thymidylate synthase
    Species: Plasmodium falciparum [TaxId:5833]
    Database cross-references and differences (RAF-indexed): Domains in SCOPe 2.08: d1j3ic_
  • Chain 'D':
    Compound: Bifunctional dihydrofolate reductase-thymidylate synthase
    Species: Plasmodium falciparum [TaxId:5833]
    Database cross-references and differences (RAF-indexed): Domains in SCOPe 2.08: d1j3id_
  • Heterogens: WRA, NDP, UMP, HOH

PDB Chain Sequences:

  • Chain 'A':
    Sequence, based on SEQRES records: (download) 
    >1j3iA (A:)
mmeqvcdvfdiyaicacckvesknegkknevfnnytfrglgnkgvlpwkcnsldmkyfca
vttyvneskyeklkykrckylnketvdnvndmpnskklqnvvvmgrtswesipkkfkpls
nrinvilsrtlkkedfdedvyiinkvedlivllgklnyykcfiiggsvvyqeflekklik
kiyftrinstyecdvffpeineneyqiisvsdvytsnnttldfiiykktnnkmlneqnci
kgeeknndmplknddkdtchmkkltefyknvdkykinyen

    Sequence, based on observed residues (ATOM records): (download) 
    >1j3iA (A:)
mmeqvcdvfdiyaicacckvesknegkknevfnnytfrglgnkgvlpwkcnsldmkyfca
vttyvneskyeklkykrckylnketkklqnvvvmgrtswesipkkfkplsnrinvilsrt
lkkedfdedvyiinkvedlivllgklnyykcfiiggsvvyqeflekklikkiyftrinst
yecdvffpeineneyqiisvsdvytsnnttldfiiykktnnkm

  • Chain 'B':
    Sequence, based on SEQRES records: (download) 
    >1j3iB (B:)
mmeqvcdvfdiyaicacckvesknegkknevfnnytfrglgnkgvlpwkcnsldmkyfca
vttyvneskyeklkykrckylnketvdnvndmpnskklqnvvvmgrtswesipkkfkpls
nrinvilsrtlkkedfdedvyiinkvedlivllgklnyykcfiiggsvvyqeflekklik
kiyftrinstyecdvffpeineneyqiisvsdvytsnnttldfiiykktnnkmlneqnci
kgeeknndmplknddkdtchmkkltefyknvdkykinyen

    Sequence, based on observed residues (ATOM records): (download) 
    >1j3iB (B:)
meqvcdvfdiyaicacckvesknegkknevfnnytfrglgnkgvlpwkcnsldmkyfcav
ttyvneskyeklkykrckylnketvdmpnskklqnvvvmgrtswesipkkfkplsnrinv
ilsrtlkkedfdedvyiinkvedlivllgklnyykcfiiggsvvyqeflekklikkiyft
rinstyecdvffpeineneyqiisvsdvytsnnttldfiiykktnn

  • Chain 'C':
    Sequence, based on SEQRES records: (download) 
    >1j3iC (C:)
ddddeeeddfvyfnfnkekeeknknsihpndfqiynslkykyhpeyqylniiydimmngn
kqsdrtgvgvlskfgyimkfdlsqyfpllttkklflrgiieellwfirgetngntllnkn
vriweangtrefldnrklfhrevndlgpiygfqwrhfgaeytnmydnyenkgvdqlknii
nlikndptsrrillcawnvkdldqmalppchilcqfyvfdgklscimyqrscdlglgvpf
niasysifthmiaqvcnlqpaqfihvlgnahvynnhidslkiqlnripypfptlklnpdi
kniedftisdftiqnyvhhekismdmaa

    Sequence, based on observed residues (ATOM records): (download) 
    >1j3iC (C:)
dddeeeddfvyfnfnkekeeknknsihpndfqiynslkykyhpeyqylniiydimmngnk
qsdrtgvgvlskfgyimkfdlsqyfpllttkklflrgiieellwfirgetngntllnknv
riweangtrefldnrklfhrevndlgpiygfqwrhfgaeytnmydnyenkgvdqlkniin
likndptsrrillcawnvkdldqmalppchilcqfyvfdgklscimyqrscdlglgvpfn
iasysifthmiaqvcnlqpaqfihvlgnahvynnhidslkiqlnripypfptlklnpdik
niedftisdftiqnyvhhekismdmaa

  • Chain 'D':
    Sequence; same for both SEQRES and ATOM records: (download) 
    >1j3iD (D:)
ddddeeeddfvyfnfnkekeeknknsihpndfqiynslkykyhpeyqylniiydimmngn
kqsdrtgvgvlskfgyimkfdlsqyfpllttkklflrgiieellwfirgetngntllnkn
vriweangtrefldnrklfhrevndlgpiygfqwrhfgaeytnmydnyenkgvdqlknii
nlikndptsrrillcawnvkdldqmalppchilcqfyvfdgklscimyqrscdlglgvpf
niasysifthmiaqvcnlqpaqfihvlgnahvynnhidslkiqlnripypfptlklnpdi
kniedftisdftiqnyvhhekismdmaa