Chlorine in PDB 4hqn: Crystal Structure of Manganese-Loaded Plasmodium Vivax Trap Protein

The structure of Crystal Structure of Manganese-Loaded Plasmodium Vivax Trap Protein, PDB code: 4hqn was solved by G.Song, A.C.Koksal, C.Lu, T.A.Springer, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	39.88 / 2.20
Space group	P 21 21 21
Cell size a, b, c (Å), α, β, γ (°)	59.586, 96.567, 159.521, 90.00, 90.00, 90.00
R / Rfree (%)	17.2 / 21.2

The structure of Crystal Structure of Manganese-Loaded Plasmodium Vivax Trap Protein also contains other interesting chemical elements:

Manganese

(Mn)

2 atoms

The binding sites of Chlorine atom in the Crystal Structure of Manganese-Loaded Plasmodium Vivax Trap Protein (pdb code 4hqn). This binding sites where shown within 5.0 Angstroms radius around Chlorine atom.
In total 2 binding sites of Chlorine where determined in the Crystal Structure of Manganese-Loaded Plasmodium Vivax Trap Protein, PDB code: 4hqn:
Jump to Chlorine binding site number: 1; 2;

Chlorine binding site 1 out of 2 in the Crystal Structure of Manganese-Loaded Plasmodium Vivax Trap Protein


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 1 of Crystal Structure of Manganese-Loaded Plasmodium Vivax Trap Protein within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl304 b:32.8 occ:1.00 OG1 A:THR130 3.1 36.4 1.0 O A:HOH531 3.2 40.5 1.0 O A:HOH497 3.3 34.7 1.0 N A:THR130 3.3 32.2 1.0 N A:SER163 3.4 30.9 1.0 N A:ASN162 3.5 28.9 1.0 CB A:ASN162 3.5 34.5 1.0 O A:THR127 3.6 36.4 1.0 N A:MET129 3.6 33.6 1.0 CB A:THR130 3.6 30.6 1.0 CA A:ASN162 3.8 25.2 1.0 CB A:PRO161 3.9 29.7 1.0 O A:SER163 4.0 32.4 1.0 CA A:THR130 4.0 32.3 1.0 C A:ASN162 4.1 38.1 1.0 CB A:MET129 4.1 34.3 1.0 CA A:MET129 4.2 32.5 1.0 C A:MET129 4.2 33.2 1.0 C A:PRO161 4.3 26.9 1.0 C A:SER128 4.3 33.2 1.0 CA A:SER163 4.4 31.1 1.0 CG A:ASN162 4.4 36.4 1.0 CA A:PRO161 4.6 25.8 1.0 CA A:SER128 4.6 34.4 1.0 CB A:ALA167 4.6 25.3 1.0 C A:SER163 4.6 32.3 1.0 CB A:SER163 4.7 33.9 1.0 ND2 A:ASN162 4.7 28.1 1.0 C A:THR127 4.7 38.7 1.0 O A:HOH639 4.9 62.2 1.0 NH1 A:ARG166 4.9 56.4 1.0 CG A:PRO161 5.0 34.4 1.0

Chlorine binding site 2 out of 2 in the Crystal Structure of Manganese-Loaded Plasmodium Vivax Trap Protein


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 2 of Crystal Structure of Manganese-Loaded Plasmodium Vivax Trap Protein within 5.0Å range: probe atom residue distance (Å) B Occ B:Cl304 b:46.3 occ:1.00 OG1 B:THR130 3.0 51.4 1.0 O B:HOH463 3.1 49.4 1.0 N B:THR130 3.2 42.9 1.0 O B:HOH521 3.3 68.1 1.0 N B:SER163 3.4 49.8 1.0 CB B:THR130 3.5 54.2 1.0 N B:MET129 3.5 46.9 1.0 N B:ASN162 3.6 42.6 1.0 O B:THR127 3.7 51.0 1.0 CB B:ASN162 3.7 46.8 1.0 O B:SER163 3.9 40.2 1.0 CA B:THR130 3.9 44.0 1.0 CB B:PRO161 3.9 39.6 1.0 CA B:ASN162 4.0 45.8 1.0 CA B:MET129 4.1 42.7 1.0 C B:MET129 4.1 45.9 1.0 C B:SER128 4.1 52.1 1.0 CB B:MET129 4.2 41.1 1.0 C B:ASN162 4.2 51.4 1.0 CA B:SER163 4.3 52.0 1.0 CA B:SER128 4.3 49.5 1.0 CB B:SER163 4.4 50.9 1.0 C B:PRO161 4.4 46.9 1.0 C B:SER163 4.5 48.3 1.0 O B:HOH522 4.5 63.5 1.0 CA B:PRO161 4.6 43.5 1.0 CG B:ASN162 4.6 55.2 1.0 C B:THR127 4.7 51.0 1.0 CB B:ALA167 4.8 37.5 1.0 ND2 B:ASN162 4.8 56.0 1.0 CG2 B:THR130 4.9 45.4 1.0 N B:ALA131 5.0 44.4 1.0 O B:SER128 5.0 55.3 1.0

G.Song, A.C.Koksal, C.Lu, T.A.Springer. Shape Change in the Receptor For Gliding Motility in Plasmodium Sporozoites. Proc.Natl.Acad.Sci.Usa V. 109 21420 2012.
ISSN: ISSN 0027-8424
PubMed: 23236185
DOI: 10.1073/PNAS.1218581109