Atomistry » Chlorine » PDB 3k1s-3k9q » 3k55
Atomistry »
  Chlorine »
    PDB 3k1s-3k9q »
      3k55 »

Chlorine in PDB 3k55: Structure of Beta Hairpin Deletion Mutant of Beta Toxin From Staphylococcus Aureus

Enzymatic activity of Structure of Beta Hairpin Deletion Mutant of Beta Toxin From Staphylococcus Aureus

All present enzymatic activity of Structure of Beta Hairpin Deletion Mutant of Beta Toxin From Staphylococcus Aureus:
3.1.4.12;

Protein crystallography data

The structure of Structure of Beta Hairpin Deletion Mutant of Beta Toxin From Staphylococcus Aureus, PDB code: 3k55 was solved by A.C.Kruse, M.Huseby, K.Shi, J.Digre, D.H.Ohlendorf, C.A.Earhart, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 31.31 / 3.35
Space group P 1 21 1
Cell size a, b, c (Å), α, β, γ (°) 151.377, 134.473, 156.990, 90.00, 116.89, 90.00
R / Rfree (%) 24.1 / 28.1

Other elements in 3k55:

The structure of Structure of Beta Hairpin Deletion Mutant of Beta Toxin From Staphylococcus Aureus also contains other interesting chemical elements:

Sodium (Na) 1 atom

Chlorine Binding Sites:

The binding sites of Chlorine atom in the Structure of Beta Hairpin Deletion Mutant of Beta Toxin From Staphylococcus Aureus (pdb code 3k55). This binding sites where shown within 5.0 Angstroms radius around Chlorine atom.
In total 3 binding sites of Chlorine where determined in the Structure of Beta Hairpin Deletion Mutant of Beta Toxin From Staphylococcus Aureus, PDB code: 3k55:
Jump to Chlorine binding site number: 1; 2; 3;

Chlorine binding site 1 out of 3 in 3k55

Go back to Chlorine Binding Sites List in 3k55
Chlorine binding site 1 out of 3 in the Structure of Beta Hairpin Deletion Mutant of Beta Toxin From Staphylococcus Aureus


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 1 of Structure of Beta Hairpin Deletion Mutant of Beta Toxin From Staphylococcus Aureus within 5.0Å range:
probe atom residue distance (Å) B Occ
D:Cl287

b:56.9
occ:1.00
O D:ARG80 3.5 62.7 1.0
O D:GLY79 3.7 47.4 1.0
O D:VAL96 3.9 66.9 1.0
O D:SER94 3.9 60.5 1.0
ND2 D:ASN129 4.4 45.5 1.0
C D:ARG80 4.4 62.6 1.0
O D:SER93 4.4 64.1 1.0
CA D:ARG80 4.5 63.1 1.0
CG2 D:VAL96 4.6 69.0 1.0
C D:SER94 4.7 61.5 1.0
C D:GLY79 4.8 46.8 1.0
CA D:SER94 4.9 61.0 1.0
C D:VAL96 4.9 68.6 1.0

Chlorine binding site 2 out of 3 in 3k55

Go back to Chlorine Binding Sites List in 3k55
Chlorine binding site 2 out of 3 in the Structure of Beta Hairpin Deletion Mutant of Beta Toxin From Staphylococcus Aureus


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 2 of Structure of Beta Hairpin Deletion Mutant of Beta Toxin From Staphylococcus Aureus within 5.0Å range:
probe atom residue distance (Å) B Occ
B:Cl287

b:57.1
occ:1.00
O B:VAL96 3.6 59.6 1.0
O B:SER94 3.7 45.7 1.0
O B:ARG80 3.9 45.8 1.0
O B:GLY79 3.9 58.0 1.0
O B:SER93 4.3 38.8 1.0
ND2 B:ASN129 4.4 52.0 1.0
CG2 B:VAL96 4.4 59.9 1.0
C B:SER94 4.4 46.1 1.0
C B:VAL96 4.7 60.3 1.0
CA B:SER94 4.7 45.8 1.0
C B:ARG80 4.7 45.3 1.0
O B:GLU98 4.8 50.9 1.0
CA B:ARG80 4.8 44.9 1.0
N B:VAL96 5.0 61.1 1.0
C B:GLU98 5.0 50.4 1.0

Chlorine binding site 3 out of 3 in 3k55

Go back to Chlorine Binding Sites List in 3k55
Chlorine binding site 3 out of 3 in the Structure of Beta Hairpin Deletion Mutant of Beta Toxin From Staphylococcus Aureus


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 3 of Structure of Beta Hairpin Deletion Mutant of Beta Toxin From Staphylococcus Aureus within 5.0Å range:
probe atom residue distance (Å) B Occ
L:Cl287

b:72.3
occ:1.00
CB L:SER229 3.6 0.9 1.0
OG L:SER229 3.7 0.7 1.0
CE1 L:HIS221 3.7 81.0 1.0
ND1 L:HIS221 3.9 80.2 1.0
CG2 L:THR266 4.1 95.1 1.0
CB L:THR266 4.5 95.2 1.0
OH K:TYR279 4.7 80.6 1.0
O L:SER229 4.8 0.2 1.0
CA L:SER229 4.9 1.0 1.0
NE2 L:HIS221 4.9 81.0 1.0

Reference:

A.C.Kruse, M.J.Huseby, K.Shi, J.Digre, D.H.Ohlendorf, C.A.Earhart. Structure of A Mutant Beta Toxin From Staphylococcus Aureus Reveals Domain Swapping and Conformational Flexibility Acta Crystallogr.,Sect.F V. 67 438 2011.
ISSN: ESSN 1744-3091
PubMed: 21505235
DOI: 10.1107/S1744309111005239
Page generated: Sat Dec 12 09:50:26 2020

Last articles

Zn in 8WB0
Zn in 8WAX
Zn in 8WAU
Zn in 8WAZ
Zn in 8WAY
Zn in 8WAV
Zn in 8WAW
Zn in 8WAT
Zn in 8W7M
Zn in 8WD3
© Copyright 2008-2020 by atomistry.com
Home   |    Site Map   |    Copyright   |    Contact us   |    Privacy