Zinc in PDB 8qhj: Human Carbonic Anhydrase XII Mimic in Complex with Lasamide (2,4- Dichloro-5-Sulfamoyl Benzoic Acid)

Enzymatic activity of Human Carbonic Anhydrase XII Mimic in Complex with Lasamide (2,4- Dichloro-5-Sulfamoyl Benzoic Acid)

All present enzymatic activity of Human Carbonic Anhydrase XII Mimic in Complex with Lasamide (2,4- Dichloro-5-Sulfamoyl Benzoic Acid):
4.2.1.1; 4.2.1.69;

Protein crystallography data

The structure of Human Carbonic Anhydrase XII Mimic in Complex with Lasamide (2,4- Dichloro-5-Sulfamoyl Benzoic Acid), PDB code: 8qhj was solved by C.Baroni, M.Ferraroni, F.Carta, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 39.74 / 1.62
Space group P 1 21 1
Cell size a, b, c (Å), α, β, γ (°) 42.164, 41.572, 71.966, 90, 104.02, 90
R / Rfree (%) 18.3 / 21.8

Other elements in 8qhj:

The structure of Human Carbonic Anhydrase XII Mimic in Complex with Lasamide (2,4- Dichloro-5-Sulfamoyl Benzoic Acid) also contains other interesting chemical elements:

Chlorine (Cl) 2 atoms

Zinc Binding Sites:

The binding sites of Zinc atom in the Human Carbonic Anhydrase XII Mimic in Complex with Lasamide (2,4- Dichloro-5-Sulfamoyl Benzoic Acid) (pdb code 8qhj). 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 Human Carbonic Anhydrase XII Mimic in Complex with Lasamide (2,4- Dichloro-5-Sulfamoyl Benzoic Acid), PDB code: 8qhj:

Zinc binding site 1 out of 1 in 8qhj

Go back to Zinc Binding Sites List in 8qhj
Zinc binding site 1 out of 1 in the Human Carbonic Anhydrase XII Mimic in Complex with Lasamide (2,4- Dichloro-5-Sulfamoyl Benzoic Acid)


Mono view


Stereo pair view

A full contact list of Zinc with other atoms in the Zn binding site number 1 of Human Carbonic Anhydrase XII Mimic in Complex with Lasamide (2,4- Dichloro-5-Sulfamoyl Benzoic Acid) within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Zn301

b:14.1
occ:1.00
 N11 A:V8I302 1.9 13.3 1.0
ND1 A:HIS119 2.0 10.2 1.0
NE2 A:HIS94 2.1 11.6 1.0
NE2 A:HIS96 2.1 12.7 1.0
CE1 A:HIS119 3.0 11.0 1.0
CD2 A:HIS96 3.0 11.5 1.0
CG A:HIS119 3.0 9.5 1.0
CE1 A:HIS94 3.0 13.6 1.0
CD2 A:HIS94 3.1 13.3 1.0
S10 A:V8I302 3.1 14.2 1.0
O12 A:V8I302 3.1 13.7 1.0
CE1 A:HIS96 3.2 12.0 1.0
CB A:HIS119 3.5 10.3 1.0
OG1 A:THR198 3.8 10.5 1.0
OE1 A:GLU106 4.0 13.2 1.0
C7 A:V8I302 4.0 16.6 1.0
C6 A:V8I302 4.0 14.8 1.0
NE2 A:HIS119 4.1 10.3 1.0
CD2 A:HIS119 4.1 10.3 1.0
O13 A:V8I302 4.2 12.3 1.0
ND1 A:HIS94 4.2 12.7 1.0
CG A:HIS94 4.2 11.2 1.0
CG A:HIS96 4.2 10.7 1.0
ND1 A:HIS96 4.3 10.9 1.0
O A:HOH527 4.3 25.7 1.0
CD A:GLU106 4.9 12.5 1.0
CA A:HIS119 5.0 10.1 1.0

Reference:

C.Baroni, M.Ferraroni, F.Carta. Human Carbonic Anhydrase XII Mimic in Complex with Lasamide (2,4-Dichloro-5-Sulfamoyl Benzoic Acid) To Be Published.
Page generated: Thu Oct 31 10:04:29 2024

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