Manganese in PDB 3s21: Crystal Structure of Cerulenin Bound Xanthomonas Campestri Olea (Co- Crystal)

The structure of Crystal Structure of Cerulenin Bound Xanthomonas Campestri Olea (Co- Crystal), PDB code: 3s21 was solved by B.R.Goblirsch, C.M.Wilmot, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	27.64 / 1.70
Space group	P 32 2 1
Cell size a, b, c (Å), α, β, γ (°)	90.516, 90.516, 69.793, 90.00, 90.00, 120.00
R / Rfree (%)	17.8 / 20.9

The binding sites of Manganese atom in the Crystal Structure of Cerulenin Bound Xanthomonas Campestri Olea (Co- Crystal) (pdb code 3s21). This binding sites where shown within 5.0 Angstroms radius around Manganese atom.
In total only one binding site of Manganese was determined in the Crystal Structure of Cerulenin Bound Xanthomonas Campestri Olea (Co- Crystal), PDB code: 3s21:

Manganese binding site 1 out of 1 in the Crystal Structure of Cerulenin Bound Xanthomonas Campestri Olea (Co- Crystal)


Mono view


Stereo pair view

A full contact list of Manganese with other atoms in the Mn binding site number 1 of Crystal Structure of Cerulenin Bound Xanthomonas Campestri Olea (Co- Crystal) within 5.0Å range: probe atom residue distance (Å) B Occ A:Mn1 b:23.3 occ:0.78 OD1 A:ASP76 2.2 29.9 1.0 ND1 A:HIS38 2.2 37.4 1.0 CG A:ASP76 3.1 33.2 1.0 CE1 A:HIS38 3.2 44.6 1.0 CG A:HIS38 3.3 36.9 1.0 OD2 A:ASP76 3.3 39.5 1.0 CB A:HIS38 3.6 34.6 1.0 O A:HOH430 4.2 39.1 1.0 CA A:HIS38 4.2 33.1 1.0 NE2 A:HIS38 4.3 38.8 1.0 CD2 A:HIS38 4.4 35.7 1.0 CB A:ASP76 4.4 31.9 1.0

B.R.Goblirsch, J.A.Frias, L.P.Wackett, C.M.Wilmot. Crystal Structures of Xanthomonas Campestris Olea Reveal Features That Promote Head-to-Head Condensation of Two Long-Chain Fatty Acids. Biochemistry V. 51 4138 2012.
ISSN: ISSN 0006-2960
PubMed: 22524624
DOI: 10.1021/BI300386M