Zinc in PDB 6otk: Carbonic Anhydrase IX Mimic Complexed with Ureido Benzene Sulfonamide MB10-596B

All present enzymatic activity of Carbonic Anhydrase IX Mimic Complexed with Ureido Benzene Sulfonamide MB10-596B:
4.2.1.1;

The structure of Carbonic Anhydrase IX Mimic Complexed with Ureido Benzene Sulfonamide MB10-596B, PDB code: 6otk was solved by A.Kota, R.Mckenna, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	39.77 / 1.12
Space group	P 1 21 1
Cell size a, b, c (Å), α, β, γ (°)	42.271, 41.433, 72.204, 90.00, 103.60, 90.00
R / Rfree (%)	16.9 / 17.3

The binding sites of Zinc atom in the Carbonic Anhydrase IX Mimic Complexed with Ureido Benzene Sulfonamide MB10-596B (pdb code 6otk). This binding sites where shown within 5.0 Angstroms radius around Zinc atom.
In total only one binding site of Zinc was determined in the Carbonic Anhydrase IX Mimic Complexed with Ureido Benzene Sulfonamide MB10-596B, PDB code: 6otk:

Zinc binding site 1 out of 1 in the Carbonic Anhydrase IX Mimic Complexed with Ureido Benzene Sulfonamide MB10-596B


Mono view


Stereo pair view

A full contact list of Zinc with other atoms in the Zn binding site number 1 of Carbonic Anhydrase IX Mimic Complexed with Ureido Benzene Sulfonamide MB10-596B within 5.0Å range: probe atom residue distance (Å) B Occ A:Zn301 b:6.9 occ:1.00 NAJ A:N7S302 1.9 7.9 1.0 NE2 A:HIS94 2.0 7.2 1.0 ND1 A:HIS119 2.0 7.0 1.0 NE2 A:HIS96 2.1 7.3 1.0 CE1 A:HIS119 2.9 7.2 1.0 OAI A:N7S302 3.0 7.8 1.0 SAG A:N7S302 3.0 7.6 1.0 CE1 A:HIS94 3.0 7.4 1.0 CD2 A:HIS96 3.0 7.2 1.0 CD2 A:HIS94 3.0 7.1 1.0 CE1 A:HIS96 3.1 7.3 1.0 CG A:HIS119 3.1 6.8 1.0 CB A:HIS119 3.6 6.9 1.0 O A:HOH544 3.8 15.3 1.0 OG1 A:THR199 3.9 7.8 1.0 OE1 A:GLU106 4.0 10.1 1.0 NE2 A:HIS119 4.1 7.9 1.0 ND1 A:HIS94 4.1 7.8 1.0 OAH A:N7S302 4.1 8.3 1.0 CG A:HIS94 4.2 7.5 1.0 CG A:HIS96 4.2 7.6 1.0 ND1 A:HIS96 4.2 8.7 1.0 CD2 A:HIS119 4.2 7.0 1.0 CAE A:N7S302 4.2 10.1 1.0 O A:HOH517 4.8 18.9 1.0 CAD A:N7S302 4.9 10.6 1.0 CD A:GLU106 4.9 9.6 1.0

A.Kota, R.Mckenna. Carbonic Anhydrase IX Mimic Complexed with Ureido Benzene Sulfonamide MB9-561B To Be Published.