Chlorine in PDB 2cuu: Crystal Structure of Spin Labeled T4 Lysozyme (V131R1)

All present enzymatic activity of Crystal Structure of Spin Labeled T4 Lysozyme (V131R1):
3.2.1.17;

The structure of Crystal Structure of Spin Labeled T4 Lysozyme (V131R1), PDB code: 2cuu was solved by M.R.Fleissner, D.Cascio, M.R.Sawaya, K.Hideg, W.L.Hubbell, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	51.99 / 1.75
Space group	P 32 2 1
Cell size a, b, c (Å), α, β, γ (°)	60.405, 60.405, 96.055, 90.00, 90.00, 120.00
R / Rfree (%)	19.1 / 22.4

The binding sites of Chlorine atom in the Crystal Structure of Spin Labeled T4 Lysozyme (V131R1) (pdb code 2cuu). This binding sites where shown within 5.0 Angstroms radius around Chlorine atom.
In total 3 binding sites of Chlorine where determined in the Crystal Structure of Spin Labeled T4 Lysozyme (V131R1), PDB code: 2cuu:
Jump to Chlorine binding site number: 1; 2; 3;

Chlorine binding site 1 out of 3 in the Crystal Structure of Spin Labeled T4 Lysozyme (V131R1)


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 Spin Labeled T4 Lysozyme (V131R1) within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl200 b:23.5 occ:1.00 O A:HOH205 3.2 16.1 1.0 O A:HOH313 3.4 26.5 1.0 CE1 A:HIS31 3.6 17.6 1.0 NE2 A:HIS31 4.0 15.6 1.0 CB A:ALA49 4.1 17.6 1.0 CA A:ALA49 4.6 17.5 1.0 NE2 A:GLN69 4.6 15.3 1.0 CD2 A:LEU66 4.7 20.2 1.0 O A:HOH339 4.8 33.3 1.0 ND1 A:HIS31 4.8 16.1 1.0

Chlorine binding site 2 out of 3 in the Crystal Structure of Spin Labeled T4 Lysozyme (V131R1)


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 Spin Labeled T4 Lysozyme (V131R1) within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl201 b:22.4 occ:1.00 O A:HOH290 3.0 16.9 1.0 N A:ARG145 3.2 14.7 1.0 N A:ASN144 3.3 14.5 1.0 C A:THR142 3.3 14.4 1.0 CA A:THR142 3.4 14.6 1.0 CB A:THR142 3.6 14.3 1.0 O A:THR142 3.6 15.1 1.0 N A:PRO143 3.7 14.7 1.0 CB A:ASN144 3.8 15.8 1.0 CA A:ASN144 3.8 15.2 1.0 CB A:ARG145 3.8 15.3 1.0 C A:ASN144 4.0 14.8 1.0 CA A:ARG145 4.1 14.9 1.0 CD A:PRO143 4.1 14.6 1.0 C A:PRO143 4.2 14.5 1.0 CG2 A:THR142 4.3 14.4 1.0 CA A:PRO143 4.5 14.1 1.0 CG A:ASN144 4.7 18.4 1.0 OG1 A:THR142 4.8 15.1 1.0 O A:HOH207 4.8 18.4 1.0 N A:THR142 4.9 14.5 1.0 CG A:PRO143 5.0 14.1 1.0

Chlorine binding site 3 out of 3 in the Crystal Structure of Spin Labeled T4 Lysozyme (V131R1)


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 3 of Crystal Structure of Spin Labeled T4 Lysozyme (V131R1) within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl202 b:27.9 occ:1.00 O A:GLU11 2.8 16.3 1.0 O A:HOH222 2.9 20.2 1.0 O A:HOH306 2.9 24.6 1.0 O A:HOH270 2.9 26.6 1.0 OH A:TYR18 2.9 21.8 1.0 OE1 A:GLU11 3.1 19.6 1.0 O A:HOH309 3.2 41.4 1.0 O A:HOH303 3.3 34.1 1.0 C A:GLU11 3.7 16.3 1.0 O A:HOH387 3.8 31.5 1.0 CZ A:TYR18 3.9 21.0 1.0 CA A:GLU11 3.9 16.3 1.0 CE2 A:TYR18 4.0 20.9 1.0 CD A:GLU11 4.3 18.4 1.0 CA A:GLY30 4.3 15.5 1.0 CB A:GLU11 4.3 16.2 1.0 N A:GLY30 4.6 15.4 1.0 O A:HOH272 4.8 30.1 1.0 O A:HOH405 4.8 43.3 1.0 O A:ASP10 4.9 16.5 1.0 CG A:GLU11 4.9 17.2 1.0 N A:GLY12 5.0 16.1 1.0

M.R.Fleissner, D.Cascio, W.L.Hubbell. Structural Origin of Weakly Ordered Nitroxide Motion in Spin-Labeled Proteins Protein Sci. V. 18 893 2009.
ISSN: ISSN 0961-8368
PubMed: 19384990
DOI: 10.1002/PRO.96