2026-09-26_00000209
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ligand
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9SMB
Human carbonic anhydrase II complexed with N-(phenylsulfonyl)-4-(4-sulfamoylphenyl)piperazine-1-carboxamide;
X-ray diffraction 1.45Å
Protein #1
260 residues (99% resolved)
Raw Sequence ...
MSHHWGYGKHNGPEHWHKDFPIAKGERQSPVDIDTHTAKYDPSLKPLSVSYDQATSLRILNNGHAFNVEFDDSQDKAVLKGGPLDGTYRLIQFHFHWGSLDGQGSEHTVDKKKYAAELHLVHWNTKYGDFGKAVQQPDGLAVLGIFLKVGSAKPGLQKVVDVLDSIKTKGKSADFTNFDPRGLLPESLDYWTYPGSLTTPPLLECVTWIVLKEPISVSSEQVLKFRKLNFNGEGEPEELMVDNWRPAQPLKNRQIKASFK
Canonical Sequence ...
MSHHWGYGKHNGPEHWHKDFPIAKGERQSPVDIDTHTAKYDPSLKPLSVSYDQATSLRILNNGHAFNVEFDDSQDKAVLKGGPLDGTYRLIQFHFHWGSLDGQGSEHTVDKKKYAAELHLVHWNTKYGDFGKAVQQPDGLAVLGIFLKVGSAKPGLQKVVDVLDSIKTKGKSADFTNFDPRGLLPESLDYWTYPGSLTTPPLLECVTWIVLKEPISVSSEQVLKFRKLNFNGEGEPEELMVDNWRPAQPLKNRQIKASFK
Non polymer #2
A1JOY
InChI=1S/C17H20N4O5S2/c18-27(23,24)15-8-6-14(7-9-15)20-10-12-21(13-11-20)17(22)19-28(25,26)16-4-2-1-3-5-16/h1-9H,10-13H2,(H,19,22)(H2,18,23,24)
InChI=1S/C17H20N4O5S2/c18-27(23,24)15-8-6-14(7-9-15)20-10-12-21(13-11-20)17(22)19-28(25,26)16-4-2-1-3-5-16/h1-9H,10-13H2,(H,19,22)(H2,18,23,24)
SMILES: c1ccc(cc1)S(=O)(=O)NC(=O)N2CCN(CC2)c3ccc(cc3)S(=O)(=O)N
c1ccc(cc1)S(=O)(=O)NC(=O)N2CCN(CC2)c3ccc(cc3)S(=O)(=O)N
Non polymer #3
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 #4
ZN
InChI=1S/Zn/q+2
InChI=1S/Zn/q+2
SMILES: [Zn+2]
[Zn+2]
Biounit #1
monomer
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Model
Reference
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