2026-10-17_00000073
|
ligand
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30FP
Crystal structure of carbonic anhydrase XIII with methyl 4-phenylsulfanyl-3-sulfamoyl-benzoate;
X-ray diffraction 2.25Å
Protein #1
263 residues (98% resolved)
Raw Sequence ...
MMSRLSWGYREHNGPIHWKEFFPIADGDQQSPIEIKTKEVKYDSSLRPLSIKYDPSSAKIISNSGHSFNVDFDDTENKSVLRGGPLTGSYRLRQVHLHWGSADDHGSEHIVDGVSYAAELHVVHWNSDKYPSFVEAAHEPDGLAVLGVFLQIGEPNSQLQKITDTLDSIKEKGKQTRFTNFDLLSLLPPSWDYWTYPGSLTVPPLLESVTWIVLKQPINISSQQLAKFRSLLCTAEGEAAAFLVSNHRPPQPLKGRKVRASFH
Canonical Sequence ...
MMSRLSWGYREHNGPIHWKEFFPIADGDQQSPIEIKTKEVKYDSSLRPLSIKYDPSSAKIISNSGHSFNVDFDDTENKSVLRGGPLTGSYRLRQVHLHWGSADDHGSEHIVDGVSYAAELHVVHWNSDKYPSFVEAAHEPDGLAVLGVFLQIGEPNSQLQKITDTLDSIKEKGKQTRFTNFDLLSLLPPSWDYWTYPGSLTVPPLLESVTWIVLKQPINISSQQLAKFRSLLCTAEGEAAAFLVSNHRPPQPLKGRKVRASFH
Non polymer #2
A1J5R
InChI=1S/C14H13NO4S2/c1-19-14(16)10-7-8-12(13(9-10)21(15,17)18)20-11-5-3-2-4-6-11/h2-9H,1H3,(H2,15,17,18)
InChI=1S/C14H13NO4S2/c1-19-14(16)10-7-8-12(13(9-10)21(15,17)18)20-11-5-3-2-4-6-11/h2-9H,1H3,(H2,15,17,18)
SMILES: COC(=O)c1ccc(c(c1)S(=O)(=O)N)Sc2ccccc2
COC(=O)c1ccc(c(c1)S(=O)(=O)N)Sc2ccccc2
Non polymer #3
ZN
InChI=1S/Zn/q+2
InChI=1S/Zn/q+2
SMILES: [Zn+2]
[Zn+2]
Biounit #1
monomer
Download coordinates
Biounit #2
monomer
Download coordinates
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Model
Reference
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