Chlorine in PDB 4hmm: Crystal Structure of Mutant Rabbit Prp 121-230 (S174N)

The structure of Crystal Structure of Mutant Rabbit Prp 121-230 (S174N), PDB code: 4hmm was solved by B.Sweeting, A.Chakrabartty, E.F.Pai, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	61.28 / 1.50
Space group	P 21 21 21
Cell size a, b, c (Å), α, β, γ (°)	29.590, 86.250, 87.080, 90.00, 90.00, 90.00
R / Rfree (%)	14.7 / 19.3

The structure of Crystal Structure of Mutant Rabbit Prp 121-230 (S174N) also contains other interesting chemical elements:

Sodium

(Na)

3 atoms

The binding sites of Chlorine atom in the Crystal Structure of Mutant Rabbit Prp 121-230 (S174N) (pdb code 4hmm). 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 Mutant Rabbit Prp 121-230 (S174N), PDB code: 4hmm:
Jump to Chlorine binding site number: 1; 2;

Chlorine binding site 1 out of 2 in the Crystal Structure of Mutant Rabbit Prp 121-230 (S174N)


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 Mutant Rabbit Prp 121-230 (S174N) within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl301 b:11.8 occ:1.00 O A:HOH434 3.2 19.5 1.0 NH1 A:ARG136 3.3 12.6 1.0 N A:ARG136 3.3 9.2 1.0 CG A:ARG136 3.7 9.4 1.0 CD A:ARG136 3.8 9.8 1.0 CB A:ARG136 3.8 10.4 1.0 CA A:SER135 4.1 14.5 1.0 CA A:ARG136 4.2 9.5 1.0 C A:SER135 4.2 11.7 1.0 CE A:MET154 4.2 10.6 1.0 CZ A:ARG136 4.3 11.6 1.0 NE A:ARG136 4.5 10.9 1.0 O A:MET134 4.7 14.2 1.0 CB A:SER135 4.8 17.7 1.0 CE1 A:TYR155 5.0 6.2 1.0

Chlorine binding site 2 out of 2 in the Crystal Structure of Mutant Rabbit Prp 121-230 (S174N)


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 Mutant Rabbit Prp 121-230 (S174N) within 5.0Å range: probe atom residue distance (Å) B Occ B:Cl301 b:12.9 occ:1.00 O B:HOH433 3.2 16.6 1.0 NH1 B:ARG136 3.3 12.6 1.0 N B:ARG136 3.3 10.9 1.0 CG B:ARG136 3.6 11.0 1.0 CB B:ARG136 3.7 9.8 1.0 CD B:ARG136 3.8 10.2 1.0 CA B:ARG136 4.1 9.1 1.0 CA B:SER135 4.2 11.8 1.0 C B:SER135 4.2 11.2 1.0 CZ B:ARG136 4.3 10.0 1.0 CE1 B:TYR155 4.5 10.8 1.0 NE B:ARG136 4.5 10.4 1.0 SD B:MET154 4.6 13.6 1.0 O B:MET134 4.8 11.9 1.0 CB B:SER135 4.8 15.8 1.0 CD1 B:TYR155 4.8 10.9 1.0 O B:ARG136 5.0 10.7 1.0

B.Sweeting, E.Brown, M.Q.Khan, A.Chakrabartty, E.F.Pai. N-Terminal Helix-Cap in Alpha-Helix 2 Modulates Beta-State Misfolding in Rabbit and Hamster Prion Proteins. Plos One V. 8 63047 2013.
ISSN: ESSN 1932-6203
PubMed: 23675452
DOI: 10.1371/JOURNAL.PONE.0063047