Chlorine in PDB 4jle: Structure of A P. Falciparum Protein

The structure of Structure of A P. Falciparum Protein, PDB code: 4jle was solved by L.Slater, I.Vakonakis, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	56.71 / 2.35
Space group	P 31 2 1
Cell size a, b, c (Å), α, β, γ (°)	71.030, 71.030, 146.400, 90.00, 90.00, 120.00
R / Rfree (%)	20.7 / 25.5

The binding sites of Chlorine atom in the Structure of A P. Falciparum Protein (pdb code 4jle). This binding sites where shown within 5.0 Angstroms radius around Chlorine atom.
In total 6 binding sites of Chlorine where determined in the Structure of A P. Falciparum Protein, PDB code: 4jle:
Jump to Chlorine binding site number: 1; 2; 3; 4; 5; 6;

Chlorine binding site 1 out of 6 in the Structure of A P. Falciparum Protein


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 1 of Structure of A P. Falciparum Protein within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl201 b:94.0 occ:1.00 CG A:GLU99 3.7 50.9 1.0 NE1 B:TRP131 4.1 45.2 1.0 CB A:LEU102 4.3 46.4 1.0 CG1 B:VAL127 4.3 55.1 1.0 O A:GLU99 4.3 47.7 1.0 CG A:LEU103 4.4 52.7 1.0 CD2 A:LEU103 4.6 53.2 1.0 OE2 A:GLU99 4.6 74.2 1.0 CD A:GLU99 4.6 72.3 1.0 CA A:GLU99 4.7 43.1 1.0 CB A:GLU99 4.8 43.9 1.0 N A:LEU103 4.8 49.4 1.0 CE2 B:TRP131 4.9 47.3 1.0 CZ2 B:TRP131 4.9 46.7 1.0 C A:LEU102 4.9 52.4 1.0 CD1 A:LEU102 5.0 48.7 1.0

Chlorine binding site 2 out of 6 in the Structure of A P. Falciparum Protein


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 2 of Structure of A P. Falciparum Protein within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl202 b:55.6 occ:1.00 CE2 A:PHE89 3.8 52.7 1.0 O A:HOH306 3.9 44.9 1.0 CZ A:PHE89 3.9 51.5 1.0 CE A:LYS85 4.3 74.2 1.0 CD2 A:HIS88 4.7 37.5 1.0 CD A:LYS85 4.9 63.8 1.0 CG A:LYS85 4.9 55.5 1.0 NZ A:LYS85 5.0 80.7 1.0

Chlorine binding site 3 out of 6 in the Structure of A P. Falciparum Protein


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 3 of Structure of A P. Falciparum Protein within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl203 b:0.4 occ:1.00 CA A:PHE107 4.0 66.3 1.0 N A:PHE107 4.1 64.8 1.0 CB A:PHE107 4.2 68.6 1.0 CB B:PHE107 4.2 61.3 1.0 CG B:PHE107 4.2 65.3 1.0 CD2 B:PHE107 4.4 69.5 1.0 O A:LEU103 4.4 54.6 1.0 C A:ALA106 4.5 65.8 1.0 CD2 A:PHE107 4.6 74.1 1.0 CB A:ALA106 4.7 61.6 1.0 O B:LEU103 4.7 55.3 1.0 CD1 B:PHE107 4.7 69.3 1.0 O A:ALA106 4.8 65.1 1.0 CG A:PHE107 4.9 71.2 1.0 C B:LEU103 5.0 55.9 1.0

Chlorine binding site 4 out of 6 in the Structure of A P. Falciparum Protein


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 4 of Structure of A P. Falciparum Protein within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl204 b:73.1 occ:1.00 NE1 A:TRP131 3.5 46.8 1.0 CG B:GLU99 3.5 67.4 1.0 CE1 B:HIS48 4.0 70.0 1.0 ND1 B:HIS48 4.0 69.4 1.0 CB B:LEU102 4.0 48.7 1.0 CZ2 A:TRP131 4.1 46.6 1.0 CE2 A:TRP131 4.1 47.8 1.0 CG1 A:VAL127 4.4 43.0 1.0 CA B:GLU99 4.4 55.0 1.0 CD1 B:LEU102 4.4 50.7 1.0 O B:GLU99 4.4 62.1 1.0 CB B:GLU99 4.4 56.1 1.0 CD B:GLU99 4.5 78.7 1.0 OE2 B:GLU99 4.6 76.3 1.0 CD1 A:TRP131 4.6 47.3 1.0 CG B:LEU102 4.9 51.2 1.0 C B:GLU99 4.9 61.1 1.0 CG B:LEU103 4.9 50.9 1.0 C B:LEU102 5.0 54.7 1.0 N B:LEU103 5.0 50.0 1.0

Chlorine binding site 5 out of 6 in the Structure of A P. Falciparum Protein


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 5 of Structure of A P. Falciparum Protein within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl205 b:90.2 occ:1.00 NE2 A:HIS153 3.3 62.2 1.0 CB B:TYR79 3.6 61.2 1.0 CG B:PRO76 3.7 80.2 1.0 CD B:PRO76 3.7 75.6 1.0 CE1 A:HIS153 4.0 61.5 1.0 CB B:PRO76 4.3 75.2 1.0 CG B:TYR79 4.3 59.8 1.0 CD2 A:HIS153 4.5 62.4 1.0 CD1 B:TYR79 4.5 60.6 1.0 CD1 A:LEU157 4.7 64.1 1.0 CA B:TYR79 4.8 62.0 1.0 N B:TYR79 4.8 64.2 1.0 N B:PRO76 4.9 74.1 1.0 CD2 A:LEU157 5.0 64.7 1.0

Chlorine binding site 6 out of 6 in the Structure of A P. Falciparum Protein


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 6 of Structure of A P. Falciparum Protein within 5.0Å range: probe atom residue distance (Å) B Occ B:Cl202 b:90.7 occ:1.00 O B:LEU114 3.5 73.0 1.0 CB B:ASN111 3.6 50.4 1.0 CB B:CYS115 3.8 72.8 1.0 O A:LEU110 3.9 64.7 1.0 CG B:ASN111 4.0 69.2 1.0 OD1 B:ASN111 4.1 62.0 1.0 CZ B:PHE107 4.2 72.7 1.0 O B:GLY112 4.2 56.2 1.0 C B:LEU114 4.3 73.2 1.0 CA B:CYS115 4.3 72.4 1.0 CE1 B:PHE107 4.4 71.5 1.0 SG B:CYS115 4.6 77.5 1.0 N B:CYS115 4.6 71.8 1.0 N B:GLY112 4.7 57.6 1.0 ND2 B:ASN111 4.7 63.1 1.0 CA B:ASN111 4.9 55.2 1.0 C A:LEU110 5.0 63.7 1.0

L.Slater, M.Erat, I.Vakonakis. Structure of A P. Falciparum Phist Domain To Be Published.