Zinc in PDB 4v1z: The 3-D Structure of the Cellobiohydrolase, CEL7A, From Aspergillus Fumigatus

All present enzymatic activity of The 3-D Structure of the Cellobiohydrolase, CEL7A, From Aspergillus Fumigatus:
3.2.1.91;

The structure of The 3-D Structure of the Cellobiohydrolase, CEL7A, From Aspergillus Fumigatus, PDB code: 4v1z was solved by O.V.Moroz, M.Maranta, T.Shaghasi, P.V.Harris, K.S.Wilson, G.J.Davies, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	67.85 / 1.78
Space group	P 21 21 2
Cell size a, b, c (Å), α, β, γ (°)	79.230, 131.390, 45.920, 90.00, 90.00, 90.00
R / Rfree (%)	14.406 / 18.895

The binding sites of Zinc atom in the The 3-D Structure of the Cellobiohydrolase, CEL7A, From Aspergillus Fumigatus (pdb code 4v1z). This binding sites where shown within 5.0 Angstroms radius around Zinc atom.
In total 2 binding sites of Zinc where determined in the The 3-D Structure of the Cellobiohydrolase, CEL7A, From Aspergillus Fumigatus, PDB code: 4v1z:
Jump to Zinc binding site number: 1; 2;

Zinc binding site 1 out of 2 in the The 3-D Structure of the Cellobiohydrolase, CEL7A, From Aspergillus Fumigatus


Mono view


Stereo pair view

A full contact list of Zinc with other atoms in the Zn binding site number 1 of The 3-D Structure of the Cellobiohydrolase, CEL7A, From Aspergillus Fumigatus within 5.0Å range: probe atom residue distance (Å) B Occ A:Zn1441 b:34.0 occ:1.00 O A:HOH2429 1.5 23.9 1.0 OE2 A:GLU415 2.0 38.8 1.0 NE2 A:HIS377 2.1 26.3 1.0 OD1 A:ASP375 2.2 18.5 1.0 OD2 A:ASP375 2.6 24.6 1.0 CG A:ASP375 2.7 19.2 1.0 CE1 A:HIS377 3.0 24.1 1.0 CD2 A:HIS377 3.2 26.1 1.0 CD A:GLU415 3.3 38.9 1.0 O A:HOH2279 3.7 50.7 1.0 CB A:PRO411 3.9 27.1 1.0 CG2 A:ILE104 4.0 24.2 1.0 CG A:GLU415 4.0 31.5 1.0 O A:HOH2278 4.1 35.5 1.0 ND1 A:HIS377 4.1 27.5 1.0 OE1 A:GLU415 4.2 35.2 1.0 CB A:ASP375 4.2 17.6 1.0 CG A:HIS377 4.3 25.4 1.0 O A:HOH2458 4.6 37.4 1.0 CG A:PRO411 4.7 25.1 1.0 CZ A:PHE95 4.8 20.1 1.0 CA A:PRO411 4.8 25.8 1.0 OD2 A:ASP198 4.8 26.6 1.0 CD1 A:ILE104 4.8 32.1 1.0 O A:ASP375 4.9 18.1 1.0 CB A:ILE104 4.9 20.1 1.0 C A:ASP375 4.9 19.9 1.0 CA A:ASP375 5.0 16.6 1.0

Zinc binding site 2 out of 2 in the The 3-D Structure of the Cellobiohydrolase, CEL7A, From Aspergillus Fumigatus


Mono view


Stereo pair view

A full contact list of Zinc with other atoms in the Zn binding site number 2 of The 3-D Structure of the Cellobiohydrolase, CEL7A, From Aspergillus Fumigatus within 5.0Å range: probe atom residue distance (Å) B Occ A:Zn1442 b:31.6 occ:1.00 O A:HOH2470 2.2 26.8 1.0 OD1 A:ASP46 2.3 29.7 1.0 O A:HOH2089 2.4 30.1 1.0 O A:HOH2088 2.6 37.0 1.0 CG A:ASP46 3.2 31.1 1.0 OD2 A:ASP46 3.4 39.6 1.0 N A:TYR47 4.0 25.6 1.0 OG1 A:THR48 4.1 31.8 1.0 CB A:TYR47 4.4 26.7 1.0 CD1 A:TYR47 4.4 35.5 1.0 CB A:ASP46 4.6 26.8 1.0 N A:THR48 4.6 20.2 1.0 CA A:TYR47 4.7 24.0 1.0 C A:TYR47 4.9 22.9 1.0 CG A:TYR47 4.9 27.6 1.0 CA A:ASP46 4.9 24.2 1.0 C A:ASP46 5.0 24.5 1.0

O.V.Moroz, M.Maranta, T.Shaghasi, P.V.Harris, K.S.Wilson, G.J.Davies. The Three-Dimensional Structure of the Cellobiohydrolase CEL7A From Aspergillus Fumigatus at 1.5 A Resolution Acta Crystallogr.,Sect.F V. 71 114 2015.
ISSN: ISSN 1744-3091
PubMed: 25615982
DOI: 10.1107/S2053230X14027307