Chlorine in PDB 3mzq: Rnase Crystals Grown By the Hanging Drop Method

All present enzymatic activity of Rnase Crystals Grown By the Hanging Drop Method:
3.1.27.5;

The structure of Rnase Crystals Grown By the Hanging Drop Method, PDB code: 3mzq was solved by I.I.Mathews, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	30.00 / 1.50
Space group	P 32 2 1
Cell size a, b, c (Å), α, β, γ (°)	64.240, 64.240, 63.680, 90.00, 90.00, 120.00
R / Rfree (%)	17.6 / 19.3

The binding sites of Chlorine atom in the Rnase Crystals Grown By the Hanging Drop Method (pdb code 3mzq). This binding sites where shown within 5.0 Angstroms radius around Chlorine atom.
In total 4 binding sites of Chlorine where determined in the Rnase Crystals Grown By the Hanging Drop Method, PDB code: 3mzq:
Jump to Chlorine binding site number: 1; 2; 3; 4;

Chlorine binding site 1 out of 4 in the Rnase Crystals Grown By the Hanging Drop Method


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 1 of Rnase Crystals Grown By the Hanging Drop Method within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl125 b:15.5 occ:1.00 OG1 A:THR3 3.1 9.9 1.0 O A:HOH191 3.1 14.5 1.0 CB A:THR3 4.1 11.1 1.0 CG2 A:THR3 4.1 11.9 1.0 CB A:ALA5 4.2 9.6 1.0 N A:ALA6 4.2 7.9 1.0 CB A:ALA6 4.2 8.0 1.0 O A:HOH177 4.2 12.2 1.0 CA A:ALA6 4.7 7.7 1.0 O A:HOH163 4.8 11.8 1.0 C A:ALA5 4.9 7.4 1.0

Chlorine binding site 2 out of 4 in the Rnase Crystals Grown By the Hanging Drop Method


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 2 of Rnase Crystals Grown By the Hanging Drop Method within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl126 b:21.4 occ:1.00 O A:HOH149 2.9 10.1 1.0 CB A:SER15 3.8 14.9 1.0 CB A:SER50 3.8 8.2 1.0 CA A:SER50 3.9 7.7 1.0 O A:SER15 4.1 21.0 1.0 OG A:SER15 4.3 12.3 1.0 O A:HOH207 4.7 23.8 1.0 N A:SER50 4.7 8.4 1.0 O A:HOH144 4.8 10.0 1.0 CA A:SER15 4.9 14.1 1.0 C A:SER15 4.9 17.5 1.0 O A:HOH139 5.0 24.3 1.0 N A:LEU51 5.0 8.6 1.0

Chlorine binding site 3 out of 4 in the Rnase Crystals Grown By the Hanging Drop Method


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 3 of Rnase Crystals Grown By the Hanging Drop Method within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl127 b:33.7 occ:1.00 O A:HOH143 2.8 7.2 1.0 O A:HOH232 2.8 22.3 1.0 O A:HOH185 3.1 13.1 1.0 CG A:GLU2 3.8 14.7 1.0 CB A:ALA6 4.0 8.0 1.0 OE2 A:GLU2 4.2 14.7 1.0 CD A:GLU2 4.5 14.7 1.0 CB A:GLU2 4.5 13.2 1.0 CA A:GLU2 4.5 13.1 1.0 O A:HOH173 4.9 13.9 1.0

Chlorine binding site 4 out of 4 in the Rnase Crystals Grown By the Hanging Drop Method


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 4 of Rnase Crystals Grown By the Hanging Drop Method within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl128 b:15.9 occ:1.00 O A:HOH130 3.2 25.6 1.0 N A:THR45 3.3 9.4 1.0 CE1 A:HIS12 3.5 10.6 1.0 O A:HOH261 3.6 28.3 1.0 CA A:ASN44 3.7 9.9 1.0 OG1 A:THR45 3.8 13.6 1.0 O A:HOH252 3.8 27.7 1.0 C A:ASN44 3.9 8.7 1.0 CD1 A:PHE120 3.9 13.9 1.0 CB A:THR45 4.0 9.0 1.0 ND1 A:HIS12 4.2 9.7 1.0 CA A:THR45 4.2 8.8 1.0 O A:VAL43 4.3 12.7 1.0 N A:ASN44 4.3 10.2 1.0 OD1 A:ASN44 4.4 14.1 1.0 NZ A:LYS41 4.4 23.9 1.0 CB A:PHE120 4.4 13.1 1.0 CG A:PHE120 4.5 12.0 1.0 NE2 A:HIS12 4.5 11.2 1.0 C A:VAL43 4.5 11.8 1.0 O A:PHE120 4.6 15.4 1.0 CG1 A:VAL43 4.7 13.2 1.0 CE1 A:PHE120 4.7 13.5 1.0 CB A:ASN44 4.8 10.7 1.0 CG A:ASN44 4.8 11.7 1.0 O A:THR45 4.9 9.0 1.0

M.A.Berger, J.H.Decker, I.I.Mathews. Diffraction Study of Protein Crystals Grown in Cryoloops and Micromounts. J.Appl.Crystallogr. V. 43 1513 2010.
ISSN: ISSN 0021-8898
PubMed: 22477781
DOI: 10.1107/S0021889810040409