Zinc in PDB 6p2t: Bshb From Bacillus Subtilis Complexed with Citrate

The structure of Bshb From Bacillus Subtilis Complexed with Citrate, PDB code: 6p2t was solved by P.D.Cook, C.E.Meloche, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	77.48 / 1.85
Space group	H 3 2
Cell size a, b, c (Å), α, β, γ (°)	98.538, 98.538, 184.877, 90.00, 90.00, 120.00
R / Rfree (%)	17.2 / 20.5

The structure of Bshb From Bacillus Subtilis Complexed with Citrate also contains other interesting chemical elements:

Sodium

(Na)

1 atom

The binding sites of Zinc atom in the Bshb From Bacillus Subtilis Complexed with Citrate (pdb code 6p2t). 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 Bshb From Bacillus Subtilis Complexed with Citrate, PDB code: 6p2t:

Zinc binding site 1 out of 1 in the Bshb From Bacillus Subtilis Complexed with Citrate


Mono view


Stereo pair view

A full contact list of Zinc with other atoms in the Zn binding site number 1 of Bshb From Bacillus Subtilis Complexed with Citrate within 5.0Å range: probe atom residue distance (Å) B Occ A:Zn301 b:33.1 occ:1.00 OD1 A:ASP15 1.9 28.7 1.0 O A:HOH454 2.0 44.5 1.0 ND1 A:HIS12 2.0 29.1 1.0 NE2 A:HIS113 2.2 27.5 1.0 CG A:ASP15 2.6 26.7 1.0 OD2 A:ASP15 2.7 27.8 1.0 CE1 A:HIS12 2.9 36.1 1.0 CG A:HIS12 3.1 30.4 1.0 CE1 A:HIS113 3.1 31.7 1.0 CD2 A:HIS113 3.2 31.6 1.0 CB A:HIS12 3.5 29.0 1.0 CB A:ASP15 4.1 25.7 1.0 O A:HOH401 4.1 51.3 1.0 NE2 A:HIS12 4.1 28.4 1.0 CD2 A:HIS12 4.2 30.4 1.0 N A:HIS12 4.2 25.1 1.0 O A:HOH462 4.2 47.5 1.0 ND1 A:HIS113 4.2 28.8 1.0 CG A:HIS113 4.3 27.1 1.0 OD1 A:ASP14 4.4 35.6 1.0 CA A:HIS12 4.4 27.1 1.0 O A:HIS12 4.6 25.9 1.0 CD1 A:ILE151 4.6 27.3 1.0 CB A:ALA11 4.6 26.9 1.0 CD2 A:HIS110 4.6 32.7 1.0 CA A:ASP15 4.7 28.2 1.0 C A:HIS12 4.9 31.4 1.0 N A:ASP15 4.9 27.6 1.0

R.L.Woodward, M.M.Castleman, C.E.Meloche, M.E.Karpen, C.G.Carlson, W.H.Yobi, J.C.Jepsen, B.W.Lewis, B.N.Zarnosky, P.D.Cook. X-Ray Crystallographic Structure of Bshb, the Zinc-Dependent Deacetylase Involved in Bacillithiol Biosynthesis. Protein Sci. 2019.
ISSN: ESSN 1469-896X
PubMed: 31867856
DOI: 10.1002/PRO.3808