PDB entry 3sb0

View 3sb0 on RCSB PDB site
Description: Crystal structure of Mycobacterium tuberculosis malate synthase in complex with 4-(2-chloro-6-fluoro-3-methylphenyl)-2,4-dioxobutanoic acid inhibitor
Class: transferase/transferase inhibitor
Keywords: inhibitor complex, Structural Genomics, Mycobacterium Tuberculosis Structural Proteomics Project, XMTB, malate synthase, TRANSFERASE-TRANSFERASE INHIBITOR complex
Deposited on 2011-06-03, released 2012-11-07
The last revision prior to the SCOPe 2.06 freeze date was dated 2013-02-20, with a file datestamp of 2013-02-15.
Experiment type: XRAY
Resolution: 2.2 Å
R-factor: 0.175
AEROSPACI score: 0.43 (click here for full SPACI score report)

Chains and heterogens:

  • Chain 'A':
    Compound: malate synthase g
    Species: Mycobacterium tuberculosis [TaxId:1773]
    Gene: glcB, GlcB (Rv1837c), MT1885, MTCY1A11.06, Rv1837c
    Database cross-references and differences (RAF-indexed):
    • Uniprot P0A5J4
      • engineered mutation (618)
    Domains in SCOPe 2.06: d3sb0a_
  • Heterogens: MG, I93, HOH

PDB Chain Sequences:

  • Chain 'A':
    Sequence, based on SEQRES records: (download) 
    >3sb0A (A:)
mtdrvsvgnlriarvlydfvnnealpgtdidpdsfwagvdkvvadltpqnqallnardel
qaqidkwhrrrviepidmdayrqflteigyllpepddftittsgvdaeitttagpqlvvp
vlnarfalnaanarwgslydalygtdvipetdgaekgptynkvrgdkviayarkflddsv
plssgsfgdatgftvqdgqlvvalpdkstglanpgqfagytgaaesptsvllinhglhie
ilidpesqvgttdragvkdvilesaittimdfedsvaavdaadkvlgyrnwlglnkgdla
aavdkdgtaflrvlnrdrnytapgggqftlpgrslmfvrnvghlmtndaivdtdgsevfe
gimdalftgliaihglkasdvngplinsrtgsiyivkpkmhgpaevaftcelfsrvedvl
glpqntmkigimdeerrttvnlkacikaaadrvvfintgfldrtgdeihtsmeagpmvrk
gtmksqpwilayedhnvdaglaagfsgraqvgkgmwtmtelmadmvetkiaqpragasta
wvpsptaatlhalhyhqvdvaavqqglagkrratieqlltiplakelawapdeireevdn
ncqsilgyvvrwvdqgvgaskvpdihdvalmedratlrissqllanwlrhgvitsadvra
slermaplvdrqnagdvayrpmapnfddsiaflaaqelilsgaqqpngytepilhrrrre
fkaraaekpapsdragddaar

    Sequence, based on observed residues (ATOM records): (download) 
    >3sb0A (A:)
tdrvsvgnlriarvlydfvnnealpgtdidpdsfwagvdkvvadltpqnqallnardelq
aqidkwhrrridmdayrqflteigyllpepddftittsgvdaeitttagpqlvvpvlnar
falnaanarwgslydalygtdvipetdgaekgptynkvrgdkviayarkflddsvplssg
sfgdatgftvqdgqlvvalpdkstglanpgqfagytgaaesptsvllinhglhieilidp
esqvgttdragvkdvilesaittimdfedsvaavdaadkvlgyrnwlglnkgdlaarvln
rdrnytapgggqftlpgrslmfvrnvghlmtndaivdtdgsevfegimdalftgliaihg
lkasdlinsrtgsiyivkpkmhgpaevaftcelfsrvedvlglpqntmkigimdeerrtt
vnlkacikaaadrvvfintgfldrtgdeihtsmeagpmvrkgtmksqpwilayedhnvda
glaagfsgraqvgkgmwtmtelmadmvetkiaqpragastawvpsptaatlhalhyhqvd
vaavqqglagkrratieqlltiplakelawapdeireevdnncqsilgyvvrwvdqgvga
skvpdihdvalmedratlrissqllanwlrhgvitsadvraslermaplvdrqnagdvay
rpmapnfddsiaflaaqelilsgaqqpngytepilhrrrrefkaraae