Zinc in PDB 4ggg: Crystal Structure of V66A/L68V Czra in the Zn(II)Bound State.

The structure of Crystal Structure of V66A/L68V Czra in the Zn(II)Bound State., PDB code: 4ggg was solved by G.C.Campanello, Z.Ma, N.E.Grossoehme, D.K.Chakrovorty, A.J.Guerra, Y.Ye, C.E.Dann Iii, K.M.Merz Jr., D.P.Giedroc, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	26.67 / 2.00
Space group	P 21 2 21
Cell size a, b, c (Å), α, β, γ (°)	46.286, 50.198, 85.877, 90.00, 90.00, 90.00
R / Rfree (%)	17.3 / 22.4

The structure of Crystal Structure of V66A/L68V Czra in the Zn(II)Bound State. also contains other interesting chemical elements:

Chlorine

(Cl)

1 atom

The binding sites of Zinc atom in the Crystal Structure of V66A/L68V Czra in the Zn(II)Bound State. (pdb code 4ggg). This binding sites where shown within 5.0 Angstroms radius around Zinc atom.
In total 3 binding sites of Zinc where determined in the Crystal Structure of V66A/L68V Czra in the Zn(II)Bound State., PDB code: 4ggg:
Jump to Zinc binding site number: 1; 2; 3;

Zinc binding site 1 out of 3 in the Crystal Structure of V66A/L68V Czra in the Zn(II)Bound State.


Mono view


Stereo pair view

A full contact list of Zinc with other atoms in the Zn binding site number 1 of Crystal Structure of V66A/L68V Czra in the Zn(II)Bound State. within 5.0Å range: probe atom residue distance (Å) B Occ A:Zn201 b:24.0 occ:1.00 ND1 A:HIS97 2.0 19.3 1.0 NE2 A:HIS100 2.1 28.0 1.0 CE1 A:HIS97 2.9 21.5 1.0 CD2 A:HIS100 3.0 27.1 1.0 CE1 A:HIS100 3.0 28.9 1.0 CG A:HIS97 3.1 18.0 1.0 CB A:HIS97 3.6 17.0 1.0 CA A:HIS97 3.7 17.1 1.0 NE2 A:HIS97 4.0 25.6 1.0 ND1 A:HIS100 4.2 31.1 1.0 CG A:HIS100 4.2 30.4 1.0 CD2 A:HIS97 4.2 19.2 1.0 O A:HIS97 4.4 24.8 1.0 C A:HIS97 4.6 23.4 1.0 N A:HIS97 4.7 15.9 1.0

Zinc binding site 2 out of 3 in the Crystal Structure of V66A/L68V Czra in the Zn(II)Bound State.


Mono view


Stereo pair view

A full contact list of Zinc with other atoms in the Zn binding site number 2 of Crystal Structure of V66A/L68V Czra in the Zn(II)Bound State. within 5.0Å range: probe atom residue distance (Å) B Occ A:Zn202 b:44.0 occ:1.00 NE2 A:HIS86 2.0 22.3 1.0 O A:HOH301 2.1 18.6 1.0 CE1 A:HIS86 2.7 24.1 1.0 CD2 A:HIS86 3.2 19.7 1.0 ND1 A:HIS86 3.9 24.1 1.0 CG A:HIS86 4.2 20.9 1.0 CG2 A:ILE85 5.0 27.7 1.0

Zinc binding site 3 out of 3 in the Crystal Structure of V66A/L68V Czra in the Zn(II)Bound State.


Mono view


Stereo pair view

A full contact list of Zinc with other atoms in the Zn binding site number 3 of Crystal Structure of V66A/L68V Czra in the Zn(II)Bound State. within 5.0Å range: probe atom residue distance (Å) B Occ B:Zn201 b:25.7 occ:1.00 NE2 B:HIS100 2.0 29.1 1.0 ND1 B:HIS97 2.1 25.3 1.0 CE1 B:HIS97 2.9 31.5 1.0 CE1 B:HIS100 2.9 32.4 1.0 CD2 B:HIS100 3.1 25.4 1.0 CG B:HIS97 3.2 27.7 1.0 CB B:HIS97 3.6 17.9 1.0 CA B:HIS97 3.7 23.6 1.0 ND1 B:HIS100 4.1 31.5 1.0 NE2 B:HIS97 4.1 26.0 1.0 CG B:HIS100 4.2 30.9 1.0 CD2 B:HIS97 4.2 26.8 1.0 O B:HIS97 4.4 21.7 1.0 C B:HIS97 4.6 26.3 1.0 N B:HIS97 4.7 19.7 1.0

G.C.Campanello, Z.Ma, N.E.Grossoehme, A.J.Guerra, B.P.Ward, R.D.Dimarchi, Y.Ye, C.E.Dann, D.P.Giedroc. Allosteric Inhibition of A Zinc-Sensing Transcriptional Repressor: Insights Into the Arsenic Repressor (Arsr) Family. J.Mol.Biol. V. 425 1143 2013.
ISSN: ISSN 0022-2836
PubMed: 23353829
DOI: 10.1016/J.JMB.2013.01.018