Structure of PDB 4aw7 Chain A Binding Site BS04 |
| >4aw7 Chain A (length=565) Species: 310297 (Phocaeicola plebeius)
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HMASVDYNTRRFLSGVSELDRSKYFNIHSTSDDDKDVGKFLADYQVGLGR
KFWGPYSYAYNKTHEVGKYPQMKPYSGNISVKRYIATEHPYVQHIQGGID
VQAAGAWSAEYYSNSELVPEFFEPLNEPFVHANDAGFTVQGQAMRELMVD
FYASIGKHIHNNPRLNGKMKVIGYAAAYPAWEDGNFNYWNTRMKMFIDRA
GAYMDGFSVHLYDGITKRSGSNSEAVLDMVEAYSYIKFGHVKPLAISEFG
GIDNKPDDSYDDISSVRSVSSFNHFLFNLMERQDNLFISIPFVSDKAEWH
ITAANNYTSYSAALFIPDNPQNLKNTTWRLNDKKYFFELWKNVKGERVDI
TSSNPDIQVQAFKDGGRLYIALDNLDDNPQTVYLNNKNSWKDVSNVTKRS
LYVNYNAGIEYTEQNVPSMPESISIVPNQTIVLVADVSSAFTNSIIRNKY
YSSEYLKPISAGSSLSFPFTGIESGSGRASLRMSIGRPVSASKKPVVKIN
GTAVSVPDNWKGYGQSNRNIFFGMIEVPFDIQLLKNGDNNVDITFSDGGG
HVSSMILQVEKYTVS |
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| Ligand ID | L6S |
| InChI | InChI=1S/C6H12O9S/c7-3-2(1-14-16(11,12)13)15-6(10)5(9)4(3)8/h2-10H,1H2,(H,11,12,13)/t2-,3+,4+,5-,6+/m0/s1 |
| InChIKey | OKUVUONOJCDUJY-SXUWKVJYSA-N |
| SMILES | | Software | SMILES |
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| ACDLabs 11.02 | O=S(=O)(O)OCC1OC(O)C(O)C(O)C1O | | OpenEye OEToolkits 1.7.0 | C(C1C(C(C(C(O1)O)O)O)O)OS(=O)(=O)O | | OpenEye OEToolkits 1.7.0 | C([C@H]1[C@H]([C@H]([C@@H]([C@@H](O1)O)O)O)O)OS(=O)(=O)O | | CACTVS 3.352 | O[CH]1O[CH](CO[S](O)(=O)=O)[CH](O)[CH](O)[CH]1O | | CACTVS 3.352 | O[C@@H]1O[C@@H](CO[S](O)(=O)=O)[C@@H](O)[C@@H](O)[C@@H]1O |
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| Formula | C6 H12 O9 S |
| Name | 6-O-sulfo-alpha-L-galactopyranose;
6-O-sulfo-alpha-L-galactose;
6-O-sulfo-L-galactose;
6-O-sulfo-galactose |
| ChEMBL | |
| DrugBank | |
| ZINC |
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| PDB chain | 4aw7 Chain B Residue 6
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| Enzyme Commision number |
3.2.1.178: beta-porphyranase. |
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