PDB entry 5g0r

View 5g0r on RCSB PDB site
Description: methyl-coenzyme m reductase I from methanothermobacter marburgensis exposed to 3-nitrooxypropanol
Class: transferase
Keywords: transferase, methyl-coenzymem, methyl-coenzymem reductase exposed to 3-nitrooxypropanol, posttranslational modification, binding sites, catalysis, coenzymes, disulfides, hydrogen, ligands, mesna, metalloporphyrins, methane, methanobacterium, nickel, oxidation-reduction, oxdoreductases, phosphothreonine, thioglycine, 3- nitrooxypropanol, inhibitor, greenhouse gas
Deposited on 2016-03-22, released 2016-04-13
The last revision prior to the SCOPe 2.08 freeze date was dated 2019-05-15, with a file datestamp of 2019-05-10.
Experiment type: XRAY
Resolution: 1.25 Å
R-factor: N/A
AEROSPACI score: 0.62 (click here for full SPACI score report)

Chains and heterogens:

  • Chain 'A':
    Compound: Methyl-coenzyme M reductase I subunit alpha
    Species: METHANOTHERMOBACTER MARBURGENSIS [TaxId:145263]
    Database cross-references and differences (RAF-indexed): Domains in SCOPe 2.08: d5g0ra1, d5g0ra2
  • Chain 'B':
    Compound: Methyl-coenzyme M reductase I subunit beta
    Species: METHANOTHERMOBACTER MARBURGENSIS [TaxId:145263]
    Database cross-references and differences (RAF-indexed): Domains in SCOPe 2.08: d5g0rb1, d5g0rb2
  • Chain 'C':
    Compound: Methyl-coenzyme M reductase I subunit gamma
    Species: METHANOTHERMOBACTER MARBURGENSIS [TaxId:145263]
    Database cross-references and differences (RAF-indexed): Domains in SCOPe 2.08: d5g0rc_
  • Chain 'D':
    Compound: Methyl-coenzyme M reductase I subunit alpha
    Species: METHANOTHERMOBACTER MARBURGENSIS [TaxId:145263]
    Database cross-references and differences (RAF-indexed): Domains in SCOPe 2.08: d5g0rd1, d5g0rd2
  • Chain 'E':
    Compound: Methyl-coenzyme M reductase I subunit beta
    Species: METHANOTHERMOBACTER MARBURGENSIS [TaxId:145263]
    Database cross-references and differences (RAF-indexed): Domains in SCOPe 2.08: d5g0re1, d5g0re2
  • Chain 'F':
    Compound: Methyl-coenzyme M reductase I subunit gamma
    Species: METHANOTHERMOBACTER MARBURGENSIS [TaxId:145263]
    Database cross-references and differences (RAF-indexed): Domains in SCOPe 2.08: d5g0rf_
  • Heterogens: MG, F43, TP7, NA, K, CL, HOH

PDB Chain Sequences:

  • Chain 'A':
    Sequence, based on SEQRES records: (download)
    >5g0rA (A:)
    madklfinalkkkfeespeekkttfytlggwkqserktefvnagkevaakrgipqynpdi
    gtplgqrvlmpyqvsttdtyvegddlhfvnnaamqqmwddirrtvivglnhahaviekrl
    gkevtpetithyletvnhampgaavvqehmvethpalvadsyvkvftgndeiadeidpaf
    vidinkqfpedqaetlkaevgdgiwqvvriptivsrtcdgattsrwsamqigmsmisayk
    qaageaatgdfayaakhaevihmgtylpvrrargenepggvpfgyladicqssrvnyedp
    vrvsldvvatgamlydqiwlgsymsggvgftqyataaytdnilddftyfgkeyvedkygl
    ceapnnmdtvldvatevtfygleqyeeypalledqfggsqraavvaaaagcstafatgna
    qtglsgwylsmylhkeqhsrlgfygydlqxqcgasnvfsirgdeglplelrgpnypnyam
    nvghqgeyagisqaphaargdafvfnplvkiafaddnlvfdftnvrgefakgalrefepa
    geralitpak
    

    Sequence, based on observed residues (ATOM records): (download)
    >5g0rA (A:)
    adklfinalkkkfeespeekkttfytlggwkqserktefvnagkevaakrgipqynpdig
    tplgqrvlmpyqvsttdtyvegddlhfvnnaamqqmwddirrtvivglnhahaviekrlg
    kevtpetithyletvnhampgaavvqehmvethpalvadsyvkvftgndeiadeidpafv
    idinkqfpedqaetlkaevgdgiwqvvriptivsrtcdgattsrwsamqigmsmisaykq
    aageaatgdfayaakhaevihmgtylpvrrargenepggvpfgyladicqssrvnyedpv
    rvsldvvatgamlydqiwlgsymsggvgftqyataaytdnilddftyfgkeyvedkyglc
    eapnnmdtvldvatevtfygleqyeeypalledqfggsqraavvaaaagcstafatgnaq
    tglsgwylsmylhkeqhsrlgfygydlqxqcgasnvfsirgdeglplelrgpnypnyamn
    vghqgeyagisqaphaargdafvfnplvkiafaddnlvfdftnvrgefakgalrefepag
    eralitpak
    

  • Chain 'B':
    Sequence, based on SEQRES records: (download)
    >5g0rB (B:)
    makfedkvdlyddrgnlveeqvplealsplrnpaiksivqgikrtvavnlegienalkta
    kvggpackimgreldldivgnaesiaaaakemiqvtedddtnvellgggkralvqvpsar
    fdvaaeysaaplvtatafvqaiinefdvsmydanmvkaavlgrypqsveymganiatmld
    ipqklegpgyalrnimvnhvvaatlkntlqaaalstileqtamfemgdavgafermhllg
    layqgmnadnlvfdlvkangkegtvgsviadlveraledgvikvekeltdykvygtddla
    mwnayaaaglmaatmvnqgaaraaqgvsstllyyndliefetglpsvdfgkvegtavgfs
    ffshsiyggggpgifngnhivtrhskgfaipcvaaamaldagtqmfspeatsglikevfs
    qvdefreplkyvveaaaeiknei
    

    Sequence, based on observed residues (ATOM records): (download)
    >5g0rB (B:)
    akfedkvdlyddrgnlveeqvplealsplrnpaiksivqgikrtvavnlegienalktak
    vggpackimgreldldivgnaesiaaaakemiqvtedddtnvellgggkralvqvpsarf
    dvaaeysaaplvtatafvqaiinefdvsmydanmvkaavlgrypqsveymganiatmldi
    pqklegpgyalrnimvnhvvaatlkntlqaaalstileqtamfemgdavgafermhllgl
    ayqgmnadnlvfdlvkangkegtvgsviadlveraledgvikvekeltdykvygtddlam
    wnayaaaglmaatmvnqgaaraaqgvsstllyyndliefetglpsvdfgkvegtavgfsf
    fshsiyggggpgifngnhivtrhskgfaipcvaaamaldagtqmfspeatsglikevfsq
    vdefreplkyvveaaaeiknei
    

  • Chain 'C':
    Sequence, based on SEQRES records: (download)
    >5g0rC (C:)
    maqyypgttkvaqnrrnfcnpeyeleklreisdedvvkilghrapgeeypsvhppleemd
    epedairemvepidgakagdrvryiqftdsmyfapaqpyvrsraylcryrgadagtlsgr
    qiietrerdlekiskelleteffdparsgvrgksvhghslrldedgmmfdmlrrqiynkd
    tgrvemvknqigdeldepvdlgepldeetlmekttiyrvdgeayrddveaveimqrihvl
    rsqggfnle
    

    Sequence, based on observed residues (ATOM records): (download)
    >5g0rC (C:)
    aqyypgttkvaqnrrnfcnpeyeleklreisdedvvkilghrapgeeypsvhppleemde
    pedairemvepidgakagdrvryiqftdsmyfapaqpyvrsraylcryrgadagtlsgrq
    iietrerdlekiskelleteffdparsgvrgksvhghslrldedgmmfdmlrrqiynkdt
    grvemvknqigdeldepvdlgepldeetlmekttiyrvdgeayrddveaveimqrihvlr
    sqggfnle
    

  • Chain 'D':
    Sequence, based on SEQRES records: (download)
    >5g0rD (D:)
    madklfinalkkkfeespeekkttfytlggwkqserktefvnagkevaakrgipqynpdi
    gtplgqrvlmpyqvsttdtyvegddlhfvnnaamqqmwddirrtvivglnhahaviekrl
    gkevtpetithyletvnhampgaavvqehmvethpalvadsyvkvftgndeiadeidpaf
    vidinkqfpedqaetlkaevgdgiwqvvriptivsrtcdgattsrwsamqigmsmisayk
    qaageaatgdfayaakhaevihmgtylpvrrargenepggvpfgyladicqssrvnyedp
    vrvsldvvatgamlydqiwlgsymsggvgftqyataaytdnilddftyfgkeyvedkygl
    ceapnnmdtvldvatevtfygleqyeeypalledqfggsqraavvaaaagcstafatgna
    qtglsgwylsmylhkeqhsrlgfygydlqxqcgasnvfsirgdeglplelrgpnypnyam
    nvghqgeyagisqaphaargdafvfnplvkiafaddnlvfdftnvrgefakgalrefepa
    geralitpak
    

    Sequence, based on observed residues (ATOM records): (download)
    >5g0rD (D:)
    adklfinalkkkfeespeekkttfytlggwkqserktefvnagkevaakrgipqynpdig
    tplgqrvlmpyqvsttdtyvegddlhfvnnaamqqmwddirrtvivglnhahaviekrlg
    kevtpetithyletvnhampgaavvqehmvethpalvadsyvkvftgndeiadeidpafv
    idinkqfpedqaetlkaevgdgiwqvvriptivsrtcdgattsrwsamqigmsmisaykq
    aageaatgdfayaakhaevihmgtylpvrrargenepggvpfgyladicqssrvnyedpv
    rvsldvvatgamlydqiwlgsymsggvgftqyataaytdnilddftyfgkeyvedkyglc
    eapnnmdtvldvatevtfygleqyeeypalledqfggsqraavvaaaagcstafatgnaq
    tglsgwylsmylhkeqhsrlgfygydlqxqcgasnvfsirgdeglplelrgpnypnyamn
    vghqgeyagisqaphaargdafvfnplvkiafaddnlvfdftnvrgefakgalrefepag
    eralitpa
    

  • Chain 'E':
    Sequence, based on SEQRES records: (download)
    >5g0rE (E:)
    makfedkvdlyddrgnlveeqvplealsplrnpaiksivqgikrtvavnlegienalkta
    kvggpackimgreldldivgnaesiaaaakemiqvtedddtnvellgggkralvqvpsar
    fdvaaeysaaplvtatafvqaiinefdvsmydanmvkaavlgrypqsveymganiatmld
    ipqklegpgyalrnimvnhvvaatlkntlqaaalstileqtamfemgdavgafermhllg
    layqgmnadnlvfdlvkangkegtvgsviadlveraledgvikvekeltdykvygtddla
    mwnayaaaglmaatmvnqgaaraaqgvsstllyyndliefetglpsvdfgkvegtavgfs
    ffshsiyggggpgifngnhivtrhskgfaipcvaaamaldagtqmfspeatsglikevfs
    qvdefreplkyvveaaaeiknei
    

    Sequence, based on observed residues (ATOM records): (download)
    >5g0rE (E:)
    akfedkvdlyddrgnlveeqvplealsplrnpaiksivqgikrtvavnlegienalktak
    vggpackimgreldldivgnaesiaaaakemiqvtedddtnvellgggkralvqvpsarf
    dvaaeysaaplvtatafvqaiinefdvsmydanmvkaavlgrypqsveymganiatmldi
    pqklegpgyalrnimvnhvvaatlkntlqaaalstileqtamfemgdavgafermhllgl
    ayqgmnadnlvfdlvkangkegtvgsviadlveraledgvikvekeltdykvygtddlam
    wnayaaaglmaatmvnqgaaraaqgvsstllyyndliefetglpsvdfgkvegtavgfsf
    fshsiyggggpgifngnhivtrhskgfaipcvaaamaldagtqmfspeatsglikevfsq
    vdefreplkyvveaaaeiknei
    

  • Chain 'F':
    Sequence, based on SEQRES records: (download)
    >5g0rF (F:)
    maqyypgttkvaqnrrnfcnpeyeleklreisdedvvkilghrapgeeypsvhppleemd
    epedairemvepidgakagdrvryiqftdsmyfapaqpyvrsraylcryrgadagtlsgr
    qiietrerdlekiskelleteffdparsgvrgksvhghslrldedgmmfdmlrrqiynkd
    tgrvemvknqigdeldepvdlgepldeetlmekttiyrvdgeayrddveaveimqrihvl
    rsqggfnle
    

    Sequence, based on observed residues (ATOM records): (download)
    >5g0rF (F:)
    aqyypgttkvaqnrrnfcnpeyeleklreisdedvvkilghrapgeeypsvhppleemde
    pedairemvepidgakagdrvryiqftdsmyfapaqpyvrsraylcryrgadagtlsgrq
    iietrerdlekiskelleteffdparsgvrgksvhghslrldedgmmfdmlrrqiynkdt
    grvemvknqigdeldepvdlgepldeetlmekttiyrvdgeayrddveaveimqrihvlr
    sqggfnle