2026-10-17_00000076
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ligand
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31BN
Akkermansia muciniphila GH95 (1120; AmGH95B);
X-ray diffraction 1.90Å
Protein #1
796 residues (95% resolved)
Raw Sequence ...
MHFQSLYLSAVAVSAVSFGWGALDKPSASNLIWSDEPAVVVYPQEDKNSEGSFGKYRKPASVWEAEGYPIGNGRVGAMIFSAPGRERLALNEISLWSGGANPGGGYGYGPDAGTNQFGNYLPFGDLFVDFKKGDQPASLSVEDFTRSLDLRDGIHKVNYKADGVTYDREAFSSTPANVLVLNYKASKPGQFSADFSVNSQLGADISAKGSVITWKGMLKNGMNYEGRVLIRPKGGTLSASGDKISVKNADSCMVVIAMETDYLMDYKKDWKGESPSRKLDRYAAKAASADYAALKQAHISQYKSMFDRVKVNFGKTEEDVAKLPTPKRLEAYKKNPADPDLEETMFQFGRYLLLSSSRPGTLPANLQGLWNDYVKPPWACDYHNNINVQMAYWGAEPANLSECHEALVNYVEAMAPGCRDASQANKGFNTKDGKPVRGWTVRTSQNIFGGNGWQWNIPGAAWYALHIWEHYAFTGDRKYLEKQAYPLMKEICHFWEDHLKELGAGGEGFKTNGKDPSEEEKKDLADVKAGTLVAPNGWSPEHGPREDGVMHDQQLIAELFSNTIKAARILGKDAAWAKSLEGKLKRLAGNKIGKEGNLQEWMIDRIPKTDHRHTSHLFAVFPGNQISKLKTPKLAEAARLSLEWRGTTGDSRRSWTWPWRTALWARLGEGNKAHEMVQGLLKFNTLPNMLTTHPPMQMDGNFGIVGGICEMLVQSHAGGLDIMPSPVEAWPEGSVKGLKARGNVTVDFSWKDGKVSNVKLYSAQPKVLPVRVNGKMTRMKTLPLKSGAGSSQPAAR
Canonical Sequence ...
MHFQSLYLSAVAVSAVSFGWGALDKPSASNLIWSDEPAVVVYPQEDKNSEGSFGKYRKPASVWEAEGYPIGNGRVGAMIFSAPGRERLALNEISLWSGGANPGGGYGYGPDAGTNQFGNYLPFGDLFVDFKKGDQPASLSVEDFTRSLDLRDGIHKVNYKADGVTYDREAFSSTPANVLVLNYKASKPGQFSADFSVNSQLGADISAKGSVITWKGMLKNGMNYEGRVLIRPKGGTLSASGDKISVKNADSCMVVIAMETDYLMDYKKDWKGESPSRKLDRYAAKAASADYAALKQAHISQYKSMFDRVKVNFGKTEEDVAKLPTPKRLEAYKKNPADPDLEETMFQFGRYLLLSSSRPGTLPANLQGLWNDYVKPPWACDYHNNINVQMAYWGAEPANLSECHEALVNYVEAMAPGCRDASQANKGFNTKDGKPVRGWTVRTSQNIFGGNGWQWNIPGAAWYALHIWEHYAFTGDRKYLEKQAYPLMKEICHFWEDHLKELGAGGEGFKTNGKDPSEEEKKDLADVKAGTLVAPNGWSPEHGPREDGVMHDQQLIAELFSNTIKAARILGKDAAWAKSLEGKLKRLAGNKIGKEGNLQEWMIDRIPKTDHRHTSHLFAVFPGNQISKLKTPKLAEAARLSLEWRGTTGDSRRSWTWPWRTALWARLGEGNKAHEMVQGLLKFNTLPNMLTTHPPMQMDGNFGIVGGICEMLVQSHAGGLDIMPSPVEAWPEGSVKGLKARGNVTVDFSWKDGKVSNVKLYSAQPKVLPVRVNGKMTRMKTLPLKSGAGSSQPAAR
Non polymer #2
CIT
InChI=1S/C6H8O7/c7-3(8)1-6(13,5(11)12)2-4(9)10/h13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)
InChI=1S/C6H8O7/c7-3(8)1-6(13,5(11)12)2-4(9)10/h13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)
SMILES: C(C(=O)O)C(CC(=O)O)(C(=O)O)O
C(C(=O)O)C(CC(=O)O)(C(=O)O)O
Non polymer #3
CL
InChI=1S/ClH/h1H/p-1
InChI=1S/ClH/h1H/p-1
SMILES: [Cl-]
[Cl-]
Non polymer #4
EDO
InChI=1S/C2H6O2/c3-1-2-4/h3-4H,1-2H2
InChI=1S/C2H6O2/c3-1-2-4/h3-4H,1-2H2
SMILES: C(CO)O
C(CO)O
Non polymer #5
NA
InChI=1S/Na/q+1
InChI=1S/Na/q+1
SMILES: [Na+]
[Na+]
Biounit #1
monomer
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Model
Reference
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