Vanadium in PDB 7q0w: Bovine Trypsin Co-Crystallized with V(IV)OSO4 and Phen

All present enzymatic activity of Bovine Trypsin Co-Crystallized with V(IV)OSO4 and Phen:
3.4.21.4;

The structure of Bovine Trypsin Co-Crystallized with V(IV)OSO4 and Phen, PDB code: 7q0w was solved by M.F.A.Santos, A.C.P.Fernandes, I.Correia, G.Sciortino, E.Garribba, T.Santos-Silva, J.C.Pessoa, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	42.68 / 1.20
Space group	P 21 21 21
Cell size a, b, c (Å), α, β, γ (°)	53.905, 56.082, 65.779, 90, 90, 90
R / Rfree (%)	12.7 / 16.2

The structure of Bovine Trypsin Co-Crystallized with V(IV)OSO4 and Phen also contains other interesting chemical elements:

Calcium

(Ca)

1 atom

The binding sites of Vanadium atom in the Bovine Trypsin Co-Crystallized with V(IV)OSO4 and Phen (pdb code 7q0w). This binding sites where shown within 5.0 Angstroms radius around Vanadium atom.
In total only one binding site of Vanadium was determined in the Bovine Trypsin Co-Crystallized with V(IV)OSO4 and Phen, PDB code: 7q0w:

Vanadium binding site 1 out of 1 in the Bovine Trypsin Co-Crystallized with V(IV)OSO4 and Phen


Mono view


Stereo pair view

A full contact list of Vanadium with other atoms in the V binding site number 1 of Bovine Trypsin Co-Crystallized with V(IV)OSO4 and Phen within 5.0Å range: probe atom residue distance (Å) B Occ A:V307 b:14.8 occ:0.70 O A:O308 1.7 16.9 0.7 O A:O309 1.7 17.6 0.7 OG A:SER195 2.0 13.4 1.0 N1 A:IMD304 2.1 16.2 0.7 N1 A:PHN306 2.1 14.1 0.7 N10 A:PHN306 2.3 14.1 0.7 C1A A:PHN306 3.0 12.8 0.7 C10 A:PHN306 3.0 13.2 0.7 CB A:SER195 3.1 12.4 1.0 C2 A:PHN306 3.1 16.5 0.7 C2 A:IMD304 3.1 15.2 0.7 C5 A:IMD304 3.1 18.0 0.7 C9 A:PHN306 3.3 15.5 0.7 NE2 A:HIS57 4.0 12.1 1.0 CA A:SER195 4.0 10.4 1.0 N A:SER195 4.0 9.4 1.0 N A:GLY193 4.0 11.1 1.0 CA A:GLN192 4.2 13.5 1.0 N3 A:IMD304 4.2 16.0 0.7 C4 A:IMD304 4.2 17.2 0.7 C4A A:PHN306 4.4 14.6 0.7 C6A A:PHN306 4.4 14.5 0.7 C3 A:PHN306 4.4 16.2 0.7 C8 A:PHN306 4.6 16.2 0.7 C A:GLN192 4.7 11.9 1.0 O A:CYS191 4.7 13.6 1.0 CD2 A:HIS57 4.8 12.5 1.0 CE1 A:HIS57 4.9 12.4 1.0 CG A:GLN192 4.9 15.8 1.0 N A:GLN192 4.9 13.9 1.0 C4 A:PHN306 4.9 16.0 0.7 CB A:GLN192 5.0 15.4 1.0 CA A:GLY193 5.0 11.1 1.0

M.F.A.Santos, G.Sciortino, I.Correia, A.C.P.Fernandes, T.Santos-Silva, F.Pisanu, E.Garribba, J.Costa Pessoa. Binding of V IV O 2+ , V IV Ol, V IV Ol 2 and V V O 2 L Moieties to Proteins: X-Ray/Theoretical Characterization and Biological Implications. Chemistry V. 28 00105 2022.
ISSN: ISSN 0947-6539
PubMed: 35486702
DOI: 10.1002/CHEM.202200105