2024-08-03_00000189
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medium
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8VIH
EgtB-IV from Crocosphaera subtropica, an ergothioneine-biosynthetic type IV sulfoxide synthase in complex with hercynine;
X-ray diffraction 1.55Å
Protein #1
468 residues (95% resolved)
Raw Sequence ...
MGSSHHHHHHSSGLVPRGSHMSFIKSQLPIFLNNCTQDSVINYFQNSWELENILMRSIIDDETFYINPDPLRNPLIFYLGHSAAFYINKLIRVELLEKGINSDYEILFEFGVDPENAEELNQAIAHINWPDVRQVWDYRNKAYEVILEVIKNTTFDLPIHASHPLWALMMGMEHQRIHFETSSMLLRQLPTEKVEKPQGWQYAPSQGVPNTNKMILVEGGTVTLGKAKDNPLYGWDCEYGDRLVKVDSFFASQYLVTNGEFLEFINRKGYETQSYWNEKSWQWKEENKVKNPKFWQFNNGKYSYRAMFDEIPLPLDWPVEVNYYEAMAYCGWKGKGTRLMSEAEWNLAAYGSNDNYQVDIEKVNDYNLNLKFGSPSPVGLVKTAQSHSGLWDLRGNVWEWLDENFHPLPGFEPHFLYEDNSAPFFDNNHKMMLGGAWVTQGTETLKYYRNWFRPNFYQHAGFRIVTNH
Canonical Sequence ...
MGSSHHHHHHSSGLVPRGSHMSFIKSQLPIFLNNCTQDSVINYFQNSWELENILMRSIIDDETFYINPDPLRNPLIFYLGHSAAFYINKLIRVELLEKGINSDYEILFEFGVDPENAEELNQAIAHINWPDVRQVWDYRNKAYEVILEVIKNTTFDLPIHASHPLWALMMGMEHQRIHFETSSMLLRQLPTEKVEKPQGWQYAPSQGVPNTNKMILVEGGTVTLGKAKDNPLYGWDCEYGDRLVKVDSFFASQYLVTNGEFLEFINRKGYETQSYWNEKSWQWKEENKVKNPKFWQFNNGKYSYRAMFDEIPLPLDWPVEVNYYEAMAYCGWKGKGTRLMSEAEWNLAAYGSNDNYQVDIEKVNDYNLNLKFGSPSPVGLVKTAQSHSGLWDLRGNVWEWLDENFHPLPGFEPHFLYEDNSAPFFDNNHKMMLGGAWVTQGTETLKYYRNWFRPNFYQHAGFRIVTNH
Non polymer #2
AVJ
InChI=1S/C9H15N3O2/c1-12(2,3)8(9(13)14)4-7-5-10-6-11-7/h5-6,8H,4H2,1-3H3,(H-,10,11,13,14)/p+1/t8-/m0/s1
InChI=1S/C9H15N3O2/c1-12(2,3)8(9(13)14)4-7-5-10-6-11-7/h5-6,8H,4H2,1-3H3,(H-,10,11,13,14)/p+1/t8-/m0/s1
SMILES: C[N+](C)(C)[C@@H](Cc1cnc[nH]1)C(=O)O
C[N+](C)(C)[C@@H](Cc1cnc[nH]1)C(=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
FE
InChI=1S/Fe/q+3
InChI=1S/Fe/q+3
SMILES: [Fe+3]
[Fe+3]
Non polymer #6
NA
InChI=1S/Na/q+1
InChI=1S/Na/q+1
SMILES: [Na+]
[Na+]
Biounit #1
monomer
Download coordinates
Biounit #2
monomer
Download coordinates
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Model
Reference
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