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Chlorine in PDB 1c64: T4 Lysozyme Mutant C54T/C97A/L121A in the Presence of 8 Atm Krypton

Enzymatic activity of T4 Lysozyme Mutant C54T/C97A/L121A in the Presence of 8 Atm Krypton

All present enzymatic activity of T4 Lysozyme Mutant C54T/C97A/L121A in the Presence of 8 Atm Krypton:
3.2.1.17;

Protein crystallography data

The structure of T4 Lysozyme Mutant C54T/C97A/L121A in the Presence of 8 Atm Krypton, PDB code: 1c64 was solved by M.L.Quillin, B.W.Matthews, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 60.00 / 2.00
Space group P 32 2 1
Cell size a, b, c (Å), α, β, γ (°) 61.189, 61.189, 96.914, 90.00, 90.00, 120.00
R / Rfree (%) n/a / n/a

Other elements in 1c64:

The structure of T4 Lysozyme Mutant C54T/C97A/L121A in the Presence of 8 Atm Krypton also contains other interesting chemical elements:

Krypton (Kr) 1 atom

Chlorine Binding Sites:

The binding sites of Chlorine atom in the T4 Lysozyme Mutant C54T/C97A/L121A in the Presence of 8 Atm Krypton (pdb code 1c64). This binding sites where shown within 5.0 Angstroms radius around Chlorine atom.
In total 2 binding sites of Chlorine where determined in the T4 Lysozyme Mutant C54T/C97A/L121A in the Presence of 8 Atm Krypton, PDB code: 1c64:
Jump to Chlorine binding site number: 1; 2;

Chlorine binding site 1 out of 2 in 1c64

Go back to Chlorine Binding Sites List in 1c64
Chlorine binding site 1 out of 2 in the T4 Lysozyme Mutant C54T/C97A/L121A in the Presence of 8 Atm Krypton


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 1 of T4 Lysozyme Mutant C54T/C97A/L121A in the Presence of 8 Atm Krypton within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Cl173

b:49.4
occ:1.00
O A:HOH426 2.9 41.8 1.0
N A:ARG145 2.9 14.9 1.0
CB A:ARG145 3.4 17.2 1.0
N A:ASN144 3.5 12.4 1.0
C A:THR142 3.6 14.4 1.0
CB A:ASN144 3.6 16.4 1.0
CB A:THR142 3.7 16.7 1.0
O A:THR142 3.7 15.1 1.0
CA A:ARG145 3.7 13.9 1.0
C A:ASN144 3.8 24.1 1.0
CA A:THR142 3.8 11.9 1.0
CA A:ASN144 3.8 15.0 1.0
N A:PRO143 4.2 20.2 1.0
O A:HOH245 4.2 34.5 1.0
O A:HOH418 4.3 37.5 1.0
C A:PRO143 4.3 20.8 1.0
CG2 A:THR142 4.6 17.3 1.0
CG A:ASN144 4.7 32.4 1.0
CD A:PRO143 4.8 15.6 1.0
OG1 A:THR142 4.8 21.4 1.0
O A:HOH237 4.8 41.3 1.0
CA A:PRO143 4.9 17.1 1.0
CG A:ARG145 4.9 23.6 1.0
C A:ARG145 4.9 15.4 1.0
O A:ASN144 4.9 15.2 1.0
N A:ALA146 4.9 17.8 1.0

Chlorine binding site 2 out of 2 in 1c64

Go back to Chlorine Binding Sites List in 1c64
Chlorine binding site 2 out of 2 in the T4 Lysozyme Mutant C54T/C97A/L121A in the Presence of 8 Atm Krypton


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 2 of T4 Lysozyme Mutant C54T/C97A/L121A in the Presence of 8 Atm Krypton within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Cl178

b:37.6
occ:0.50
O A:HOH215 2.9 21.5 1.0
O A:HOH200 3.1 31.9 1.0
O A:HOH182 3.4 28.8 1.0
CB A:ALA49 3.7 20.6 1.0
CE1 A:HIS31 4.1 19.0 1.0
CD2 A:LEU66 4.1 21.3 1.0
CA A:ALA49 4.1 22.6 1.0
NE2 A:HIS31 4.2 18.7 1.0
NE2 A:GLN69 4.2 20.5 1.0
O A:HOH282 4.3 35.7 1.0
O A:ALA49 4.6 18.5 1.0
C A:ALA49 4.9 28.1 1.0

Reference:

M.L.Quillin, W.A.Breyer, I.J.Griswold, B.W.Matthews. Size Versus Polarizability in Protein-Ligand Interactions: Binding of Noble Gases Within Engineered Cavities in Phage T4 Lysozyme. J.Mol.Biol. V. 302 955 2000.
ISSN: ISSN 0022-2836
PubMed: 10993735
DOI: 10.1006/JMBI.2000.4063
Page generated: Sat Dec 12 08:32:30 2020

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