Reaction Details Report a problem with these data
Target
Carbonic anhydrase 2 [F130V]
Ligand
BDBM12019
Substrate
BDBM11402
Meas. Tech.
In vitro binding of inhibitor to hCA-II
pH
7.4±n/a
Temperature
310.15±n/a K
Kd
3.9±n/a nM
Citation
 Kim, CY; Chandra, PP; Jain, A; Christianson, DW Fluoroaromatic-fluoroaromatic interactions between inhibitors bound in the crystal lattice of human carbonic anhydrase II. J Am Chem Soc 123:9620-7 (2001) [PubMed]  Article 
Target
Name:
Carbonic anhydrase 2 [F130V]
Synonyms:
CA-II | CA2 | CAH2_HUMAN | Carbonate dehydratase II | Carbonic Anhydrase II Mutant (F130V) | Carbonic anhydrase C
Type:
Enzyme
Mol. Mass.:
29202.67
Organism:
Homo sapiens (Human)
Description:
P00918[F130V]
Residue:
260
Sequence:
MSHHWGYGKHNGPEHWHKDFPIAKGERQSPVDIDTHTAKYDPSLKPLSVSYDQATSLRILNNGHAFNVEFDDSQDKAVLKGGPLDGTYRLIQFHFHWGSLDGQGSEHTVDKKKYAAELHLVHWNTKYGDVGKAVQQPDGLAVLGIFLKVGSAKPGLQKVVDVLDSIKTKGKSADFTNFDPRGLLPESLDYWTYPGSLTTPPLLECVTWIVLKEPISVSSEQVLKFRKLNFNGEGEPEELMVDNWRPAQPLKNRQIKASFK
  
Inhibitor
Name:
BDBM12019
Synonyms:
2,6-difluoro-SBB | 4-(AMINOSULFONYL)-N-[(2,6-DIFLUOROPHENYL)METHYL]-BENZAMIDE | N-[(2,6-difluorophenyl)methyl]-4-sulfamoylbenzamide
Type:
Small organic molecule
Emp. Form.:
C14H12F2N2O3S
Mol. Mass.:
326.318
SMILES:
NS(=O)(=O)c1ccc(cc1)C(=O)NCc1c(F)cccc1F
Structure:
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Substrate
Name:
BDBM11402
Synonyms:
5-(dimethylamino)naphthalene-1-sulfonamide | dansylamide
Type:
Small organic molecule
Emp. Form.:
C12H14N2O2S
Mol. Mass.:
250.317
SMILES:
CN(C)c1cccc2c(cccc12)S(N)(=O)=O
Structure:
Search PDB for entries with ligand similarity: