Reaction Details Report a problem with these data
Target
Carbonic anhydrase 2
Ligand
BDBM223998
Substrate
n/a
Meas. Tech.
Fluorescence-Based CA II Binding Assay
pH
7±0
Temperature
298.15±0 K
IC50
914± 62 nM
Citation
 Teruya, K; Rankin, GM; Chrysanthopoulos, PK; Tonissen, KF; Poulsen, SA Characterisation of Photoaffinity-Based Chemical Probes by Fluorescence Imaging and Native-State Mass Spectrometry. Chembiochem 18:739-754 (2017) [PubMed]  Article 
Target
Name:
Carbonic anhydrase 2
Synonyms:
CA-II | CA2 | CAC | CAH2_HUMAN | Carbonate dehydratase II | Carbonic anhydrase 2 (CA II) | Carbonic anhydrase 2 (CA-II) | Carbonic anhydrase 2 (Recombinant CA II) | Carbonic anhydrase C | Carbonic anhydrase II (CA II) | Carbonic anhydrase II (CA-II) | Carbonic anhydrase II (CAII) | Carbonic anhydrase II (hCA II) | Carbonic anhydrase isoenzyme II (hCA II)
Type:
Enzyme
Mol. Mass.:
29250.71
Organism:
Homo sapiens (Human)
Description:
P00918
Residue:
260
Sequence:
MSHHWGYGKHNGPEHWHKDFPIAKGERQSPVDIDTHTAKYDPSLKPLSVSYDQATSLRILNNGHAFNVEFDDSQDKAVLKGGPLDGTYRLIQFHFHWGSLDGQGSEHTVDKKKYAAELHLVHWNTKYGDFGKAVQQPDGLAVLGIFLKVGSAKPGLQKVVDVLDSIKTKGKSADFTNFDPRGLLPESLDYWTYPGSLTTPPLLECVTWIVLKEPISVSSEQVLKFRKLNFNGEGEPEELMVDNWRPAQPLKNRQIKASFK
  
Inhibitor
Name:
BDBM223998
Synonyms:
N-{4-[4-(4,7,10,13,16-Pentaoxanonadec-18-ynamido)benzoyl]-phenyl}-N’-(3-sulfamoylphenyl)pentanediamide (5)
Type:
Small organic molecule
Emp. Form.:
C38H46N4O11S
Mol. Mass.:
766.857
SMILES:
NS(=O)(=O)c1cccc(NC(=O)CCCC(=O)Nc2ccc(cc2)C(=O)c2ccc(NC(=O)CCOCCOCCOCCOCCOCC#C)cc2)c1
Structure:
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