Chlorine in PDB 3kfi: Major Mouse Urinary Protein IV Complexed with 2,5-Dimethylpyrazine

The structure of Major Mouse Urinary Protein IV Complexed with 2,5-Dimethylpyrazine, PDB code: 3kfi was solved by S.Perez-Miller, Q.Zou, T.D.Hurley, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	17.80 / 1.42
Space group	P 21 21 21
Cell size a, b, c (Å), α, β, γ (°)	47.838, 53.444, 61.479, 90.00, 90.00, 90.00
R / Rfree (%)	14.8 / 18.1

The binding sites of Chlorine atom in the Major Mouse Urinary Protein IV Complexed with 2,5-Dimethylpyrazine (pdb code 3kfi). This binding sites where shown within 5.0 Angstroms radius around Chlorine atom.
In total 2 binding sites of Chlorine where determined in the Major Mouse Urinary Protein IV Complexed with 2,5-Dimethylpyrazine, PDB code: 3kfi:
Jump to Chlorine binding site number: 1; 2;

Chlorine binding site 1 out of 2 in the Major Mouse Urinary Protein IV Complexed with 2,5-Dimethylpyrazine


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 1 of Major Mouse Urinary Protein IV Complexed with 2,5-Dimethylpyrazine within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl201 b:22.2 occ:0.75 O A:HOH560 3.1 32.9 1.0 O A:HOH509 3.2 25.9 1.0 N A:ARG156 3.3 22.0 1.0 CG A:LEU158 3.7 23.8 1.0 N A:LEU158 3.7 24.3 1.0 N A:CYS157 3.8 22.6 1.0 OD1 A:ASN155 3.9 23.8 1.0 O A:THR154 3.9 22.5 1.0 CB A:LEU158 4.0 24.7 1.0 CD1 A:LEU158 4.0 25.3 1.0 CA A:ASN155 4.0 22.0 1.0 CA A:ARG156 4.1 22.4 1.0 C A:ASN155 4.1 21.9 1.0 CB A:ARG156 4.2 23.3 1.0 C A:ARG156 4.2 22.6 1.0 O A:HOH577 4.4 32.2 1.0 O A:HOH618 4.4 30.9 1.0 CA A:LEU158 4.5 24.7 1.0 CA A:CYS157 4.6 23.3 1.0 C A:CYS157 4.7 24.0 1.0 CG A:ASN155 4.8 23.0 1.0 C A:THR154 4.9 21.2 1.0 N A:ASN155 5.0 21.8 1.0 CD2 A:LEU158 5.0 25.3 1.0 CB A:ASN155 5.0 22.1 1.0

Chlorine binding site 2 out of 2 in the Major Mouse Urinary Protein IV Complexed with 2,5-Dimethylpyrazine


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 2 of Major Mouse Urinary Protein IV Complexed with 2,5-Dimethylpyrazine within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl202 b:35.3 occ:0.50 O A:HOH575 3.3 38.6 1.0 ND1 A:HIS35 4.2 33.8 1.0 O A:HOH514 4.6 26.7 1.0 CB A:HIS35 4.6 27.5 1.0 O A:HOH713 4.6 49.8 1.0 CG A:HIS35 4.8 29.7 1.0

S.Perez-Miller, Q.Zou, M.V.Novotny, T.D.Hurley. High Resolution X-Ray Structures of Mouse Major Urinary Protein Nasal Isoform in Complex with Pheromones. Protein Sci. V. 19 1469 2010.
ISSN: ISSN 0961-8368
PubMed: 20509168
DOI: 10.1002/PRO.426