Chlorine in PDB 6rps: X-Ray Crystal Structure of Carbonic Anhydrase XII Complexed with A Theranostic Monoclonal Antibody Fragment

Enzymatic activity of X-Ray Crystal Structure of Carbonic Anhydrase XII Complexed with A Theranostic Monoclonal Antibody Fragment

All present enzymatic activity of X-Ray Crystal Structure of Carbonic Anhydrase XII Complexed with A Theranostic Monoclonal Antibody Fragment:
4.2.1.1;

Protein crystallography data

The structure of X-Ray Crystal Structure of Carbonic Anhydrase XII Complexed with A Theranostic Monoclonal Antibody Fragment, PDB code: 6rps was solved by V.Alterio, D.Esposito, G.De Simone, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 49.65 / 2.79
Space group I 2 2 2
Cell size a, b, c (Å), α, β, γ (°) 77.335, 222.165, 266.988, 90.00, 90.00, 90.00
R / Rfree (%) 20.3 / 23.1

Other elements in 6rps:

The structure of X-Ray Crystal Structure of Carbonic Anhydrase XII Complexed with A Theranostic Monoclonal Antibody Fragment also contains other interesting chemical elements:

Cadmium (Cd) 4 atoms
Zinc (Zn) 2 atoms

Chlorine Binding Sites:

The binding sites of Chlorine atom in the X-Ray Crystal Structure of Carbonic Anhydrase XII Complexed with A Theranostic Monoclonal Antibody Fragment (pdb code 6rps). This binding sites where shown within 5.0 Angstroms radius around Chlorine atom.
In total only one binding site of Chlorine was determined in the X-Ray Crystal Structure of Carbonic Anhydrase XII Complexed with A Theranostic Monoclonal Antibody Fragment, PDB code: 6rps:

Chlorine binding site 1 out of 1 in 6rps

Go back to Chlorine Binding Sites List in 6rps
Chlorine binding site 1 out of 1 in the X-Ray Crystal Structure of Carbonic Anhydrase XII Complexed with A Theranostic Monoclonal Antibody Fragment


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 1 of X-Ray Crystal Structure of Carbonic Anhydrase XII Complexed with A Theranostic Monoclonal Antibody Fragment within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Cl305

b:26.3
occ:1.00
NH2 A:ARG195 3.4 46.3 1.0
NE A:ARG195 3.7 50.6 1.0
NE A:ARG254 3.7 34.2 1.0
CZ A:ARG195 4.0 48.6 1.0
NH2 A:ARG254 4.2 37.5 1.0
CZ A:ARG254 4.3 37.5 1.0
CD A:ARG254 4.5 32.7 1.0
CG A:ARG254 4.6 34.4 1.0
CD A:ARG195 4.8 42.1 1.0

Reference:

V.Alterio, M.Kellner, D.Esposito, F.Liesche-Starnecker, S.Bua, C.T.Supuran, S.M.Monti, R.Zeidler, G.De Simone. Biochemical and Structural Insights Into Carbonic Anhydrase XII/FAB6A10 Complex. J.Mol.Biol. 2019.
ISSN: ESSN 1089-8638
PubMed: 31682835
DOI: 10.1016/J.JMB.2019.10.022
Page generated: Sat Dec 12 13:37:18 2020

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