Sodium in PDB 5iny: Xanthomonas Campestris Peroxiredoxin Q - Structure F8

The structure of Xanthomonas Campestris Peroxiredoxin Q - Structure F8, PDB code: 5iny was solved by A.Perkins, D.Parsonage, K.J.Nelson, L.B.Poole, A.Karplus, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	11.44 / 1.04
Space group	P 1 21 1
Cell size a, b, c (Å), α, β, γ (°)	35.480, 51.280, 39.990, 90.00, 103.94, 90.00
R / Rfree (%)	12.3 / 14.5

The binding sites of Sodium atom in the Xanthomonas Campestris Peroxiredoxin Q - Structure F8 (pdb code 5iny). This binding sites where shown within 5.0 Angstroms radius around Sodium atom.
In total 2 binding sites of Sodium where determined in the Xanthomonas Campestris Peroxiredoxin Q - Structure F8, PDB code: 5iny:
Jump to Sodium binding site number: 1; 2;

Sodium binding site 1 out of 2 in the Xanthomonas Campestris Peroxiredoxin Q - Structure F8


Mono view


Stereo pair view

A full contact list of Sodium with other atoms in the Na binding site number 1 of Xanthomonas Campestris Peroxiredoxin Q - Structure F8 within 5.0Å range: probe atom residue distance (Å) B Occ A:Na201 b:18.9 occ:1.00 O A:HOH445 2.8 15.5 1.0 HD23 A:LEU128 2.8 8.5 0.5 O A:HIS33 2.8 9.2 1.0 O A:SER129 2.9 8.2 1.0 O A:HIS30 3.4 10.2 1.0 HB3 A:HIS30 3.4 12.1 1.0 HG A:LEU128 3.4 8.1 0.5 HA A:PRO130 3.5 11.3 1.0 HB3 A:LEU128 3.5 13.3 0.5 HB3 A:LEU35 3.5 11.3 1.0 HB2 A:LEU35 3.6 11.3 1.0 CD2 A:LEU128 3.6 7.1 0.5 HB2 A:HIS30 3.7 12.1 1.0 HB3 A:LEU128 3.7 9.2 0.5 O A:LEU128 3.8 7.1 0.5 C A:SER129 3.8 7.9 1.0 HD21 A:LEU128 3.8 8.5 0.5 C A:HIS30 3.9 9.3 1.0 CG A:LEU128 3.9 6.8 0.5 HA A:ALA31 3.9 11.5 1.0 CB A:HIS30 4.0 10.1 1.0 H A:GLY132 4.0 12.9 1.0 CB A:LEU35 4.0 9.4 1.0 C A:HIS33 4.1 8.7 1.0 HA2 A:GLY132 4.1 13.1 1.0 H A:HIS33 4.1 11.7 1.0 O A:LEU128 4.2 7.7 0.5 CA A:PRO130 4.2 9.4 1.0 H A:LEU35 4.2 9.1 1.0 HA A:TRP34 4.2 9.5 1.0 O A:HOH440 4.2 9.7 0.3 HB2 A:LEU128 4.3 13.3 0.5 C A:LEU128 4.3 7.3 0.5 CB A:LEU128 4.3 7.7 0.5 CB A:LEU128 4.3 11.1 0.5 N A:LEU35 4.3 7.6 1.0 N A:PRO130 4.4 8.3 1.0 HD22 A:LEU128 4.4 8.5 0.5 C A:LEU128 4.4 8.1 0.5 C A:PRO130 4.4 9.9 1.0 HD22 A:LEU35 4.5 14.2 1.0 N A:ALA31 4.5 9.3 1.0 HD23 A:LEU35 4.5 14.2 1.0 O A:PRO130 4.5 11.2 1.0 C A:TRP34 4.6 7.2 1.0 CA A:HIS30 4.6 9.1 1.0 N A:GLY132 4.6 10.7 1.0 CA A:ALA31 4.6 9.6 1.0 HD23 A:LEU128 4.7 14.2 0.5 H A:GLY32 4.7 11.3 1.0 CA A:TRP34 4.7 7.9 1.0 O A:LEU27 4.8 8.0 1.0 N A:SER129 4.8 7.9 1.0 N A:HIS33 4.8 9.8 1.0 CA A:GLY132 4.8 10.9 1.0 CA A:LEU35 4.9 7.3 1.0 N A:TRP34 4.9 8.4 1.0 CD2 A:LEU35 4.9 11.8 1.0 CA A:SER129 4.9 7.6 1.0 CA A:LEU128 5.0 7.2 0.5

Sodium binding site 2 out of 2 in the Xanthomonas Campestris Peroxiredoxin Q - Structure F8


Mono view


Stereo pair view

A full contact list of Sodium with other atoms in the Na binding site number 2 of Xanthomonas Campestris Peroxiredoxin Q - Structure F8 within 5.0Å range: probe atom residue distance (Å) B Occ A:Na202 b:9.7 occ:1.00 HG A:SER44 2.4 14.2 1.0 HD3 A:LYS86 2.7 17.5 0.5 HD1 A:PHE83 2.7 8.8 1.0 HA A:PHE83 3.0 8.4 1.0 OG A:SER44 3.0 11.8 1.0 HB3 A:LYS86 3.2 10.5 0.5 HB3 A:SER44 3.2 12.9 1.0 HB3 A:LYS86 3.2 11.9 0.5 HG2 A:LYS86 3.3 16.3 0.5 OE1 A:GLN87 3.3 9.6 1.0 CD1 A:PHE83 3.6 7.4 1.0 CB A:SER44 3.6 10.8 1.0 HG2 A:GLN87 3.6 8.4 1.0 O A:HOH301 3.6 31.3 0.6 CD A:LYS86 3.6 14.6 0.5 HA A:SER44 3.6 11.0 1.0 HG2 A:LYS86 3.8 13.4 0.5 HZ3 A:LYS86 3.8 23.6 0.5 CB A:LYS86 3.9 8.7 0.5 CG A:LYS86 3.9 13.6 0.5 CB A:LYS86 3.9 9.9 0.5 CG A:LYS86 4.0 11.2 0.5 HE2 A:LYS86 4.0 21.5 0.5 CA A:PHE83 4.0 7.0 1.0 HD21 A:ASN82 4.0 17.3 0.3 HB2 A:LYS86 4.1 10.5 0.5 HG3 A:LYS86 4.1 16.3 0.5 HE1 A:PHE83 4.1 9.0 1.0 CA A:SER44 4.2 9.1 1.0 HB2 A:LYS86 4.2 11.9 0.5 CD A:GLN87 4.2 6.9 1.0 CE A:LYS86 4.2 17.9 0.5 HD2 A:LYS86 4.3 17.5 0.5 CG A:GLN87 4.3 7.0 1.0 CE1 A:PHE83 4.3 7.5 1.0 HD22 A:ASN82 4.3 17.3 0.3 ND2 A:ASN82 4.4 14.4 0.3 HB2 A:SER44 4.4 12.9 1.0 CG A:PHE83 4.5 7.0 1.0 HG3 A:GLN87 4.5 8.4 1.0 NZ A:LYS86 4.5 19.7 0.5 O A:HOH398 4.5 27.9 1.0 O A:PHE83 4.5 7.1 1.0 HB2 A:PHE83 4.5 8.6 1.0 CB A:PHE83 4.6 7.2 1.0 O A:ASN82 4.7 8.7 0.7 O A:HOH431 4.7 18.8 1.0 C A:PHE83 4.8 6.9 1.0 N A:PHE83 4.8 7.4 1.0 O A:ASN82 4.8 7.4 0.3 HG3 A:LYS86 4.9 13.4 0.5 HZ2 A:LYS86 4.9 23.6 0.5

A.Perkins, D.Parsonage, K.J.Nelson, O.M.Ogba, P.H.Cheong, L.B.Poole, P.A.Karplus. Peroxiredoxin Catalysis at Atomic Resolution. Structure V. 24 1668 2016.
ISSN: ISSN 0969-2126
PubMed: 27594682
DOI: 10.1016/J.STR.2016.07.012