Atomistry » Chlorine » PDB 3ktf-3l28 » 3kzl
Atomistry »
  Chlorine »
    PDB 3ktf-3l28 »
      3kzl »

Chlorine in PDB 3kzl: Crystal Structure of BA2930 Mutant (H183G) in Complex with Accoa

Protein crystallography data

The structure of Crystal Structure of BA2930 Mutant (H183G) in Complex with Accoa, PDB code: 3kzl was solved by M.M.Klimecka, M.Chruszcz, P.J.Porebski, M.Cymborowski, W.F.Anderson, W.Minor, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 34.57 / 2.10
Space group P 1 21 1
Cell size a, b, c (Å), α, β, γ (°) 71.831, 109.182, 73.721, 90.00, 111.91, 90.00
R / Rfree (%) 18 / 23.2

Other elements in 3kzl:

The structure of Crystal Structure of BA2930 Mutant (H183G) in Complex with Accoa also contains other interesting chemical elements:

Magnesium (Mg) 2 atoms

Chlorine Binding Sites:

Pages:

>>> Page 1 <<< Page 2, Binding sites: 11 - 11;

Binding sites:

The binding sites of Chlorine atom in the Crystal Structure of BA2930 Mutant (H183G) in Complex with Accoa (pdb code 3kzl). This binding sites where shown within 5.0 Angstroms radius around Chlorine atom.
In total 11 binding sites of Chlorine where determined in the Crystal Structure of BA2930 Mutant (H183G) in Complex with Accoa, PDB code: 3kzl:
Jump to Chlorine binding site number: 1; 2; 3; 4; 5; 6; 7; 8; 9; 10;

Chlorine binding site 1 out of 11 in 3kzl

Go back to Chlorine Binding Sites List in 3kzl
Chlorine binding site 1 out of 11 in the Crystal Structure of BA2930 Mutant (H183G) in Complex with Accoa


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 BA2930 Mutant (H183G) in Complex with Accoa within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Cl267

b:38.0
occ:1.00
 N A:ALA99 3.3 14.4 1.0
CD A:ARG207 3.7 21.9 1.0
CA A:PRO98 3.7 14.7 1.0
CB A:ALA99 3.9 13.9 1.0
CG A:ARG207 4.0 24.0 1.0
C A:PRO98 4.0 14.7 1.0
CB A:ARG207 4.1 25.1 1.0
NE A:ARG207 4.2 20.9 1.0
CA A:ALA99 4.2 14.2 1.0
O A:HOH464 4.3 22.3 1.0
CB A:PRO98 4.3 15.0 1.0
O A:VAL97 4.8 12.1 1.0
N A:PRO98 4.9 13.9 1.0
CD1 A:ILE202 5.0 23.8 1.0

Chlorine binding site 2 out of 11 in 3kzl

Go back to Chlorine Binding Sites List in 3kzl
Chlorine binding site 2 out of 11 in the Crystal Structure of BA2930 Mutant (H183G) in Complex with Accoa


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 BA2930 Mutant (H183G) in Complex with Accoa within 5.0Å range:
probe atom residue distance (Å) B Occ
D:Cl267

b:37.3
occ:1.00
 O D:HOH536 2.9 24.9 1.0
O D:HOH415 3.0 32.4 1.0
N D:ARG125 3.0 12.0 1.0
CE1 D:HIS103 3.7 19.4 1.0
O D:ARG125 3.7 10.7 1.0
CA D:VAL124 3.8 13.0 1.0
C D:VAL124 3.9 13.4 1.0
CA D:ARG125 3.9 11.9 1.0
CB D:ARG125 4.1 12.2 1.0
CG1 D:VAL124 4.2 15.5 1.0
ND1 D:HIS103 4.2 15.9 1.0
C D:ARG125 4.3 12.3 1.0
O D:VAL123 4.4 12.9 1.0
CB D:VAL124 4.5 13.7 1.0
CB D:PRO102 4.5 13.3 1.0
NE2 D:HIS103 4.5 19.1 1.0
CG2 D:VAL124 4.8 12.7 1.0
O D:HOH513 4.9 31.7 1.0
N D:VAL124 4.9 12.9 1.0
CG D:PRO102 5.0 14.2 1.0
O D:HOH288 5.0 14.3 1.0

Chlorine binding site 3 out of 11 in 3kzl

Go back to Chlorine Binding Sites List in 3kzl
Chlorine binding site 3 out of 11 in the Crystal Structure of BA2930 Mutant (H183G) in Complex with Accoa


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 BA2930 Mutant (H183G) in Complex with Accoa within 5.0Å range:
probe atom residue distance (Å) B Occ
D:Cl268

b:41.6
occ:1.00
 N D:GLU155 3.2 13.7 1.0
CG1 D:VAL187 3.5 12.4 1.0
CA D:GLY154 3.6 14.3 1.0
CB D:MSE151 3.7 20.0 1.0
CG D:GLU155 3.8 14.2 1.0
O D:HOH286 3.9 9.6 1.0
CG D:MSE151 3.9 22.9 1.0
C D:GLY154 3.9 13.5 1.0
CB D:GLU155 4.1 13.9 1.0
CA D:GLU155 4.3 14.0 1.0
CE D:MSE151 4.3 28.0 1.0
N D:GLY154 4.8 14.6 1.0
O D:HOH486 4.8 17.8 1.0
CB D:VAL187 4.9 14.3 1.0
O D:MSE151 4.9 17.2 1.0

Chlorine binding site 4 out of 11 in 3kzl

Go back to Chlorine Binding Sites List in 3kzl
Chlorine binding site 4 out of 11 in the Crystal Structure of BA2930 Mutant (H183G) in Complex with Accoa


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 4 of Crystal Structure of BA2930 Mutant (H183G) in Complex with Accoa within 5.0Å range:
probe atom residue distance (Å) B Occ
D:Cl269

b:38.5
occ:1.00
 N D:THR234 3.2 20.1 1.0
CA D:GLY233 3.4 20.6 1.0
OG1 D:THR234 3.7 22.6 1.0
CG D:ASP252 3.7 13.7 1.0
CB D:ASP252 3.7 11.0 1.0
C D:GLY233 3.8 20.6 1.0
O D:HOH300 3.9 13.6 1.0
CE1 D:PHE229 3.9 16.2 1.0
OD2 D:ASP252 4.0 16.8 1.0
CB D:THR234 4.0 20.9 1.0
OD1 D:ASP252 4.1 15.5 1.0
CA D:THR234 4.2 20.7 1.0
CZ D:PHE229 4.3 15.2 1.0
CA D:ASP252 4.5 10.8 1.0
N D:GLY233 4.8 21.3 1.0
O D:THR234 4.9 19.4 1.0
O D:ASP252 4.9 11.2 1.0
C D:ASP252 4.9 10.8 1.0
O D:LYS232 4.9 22.8 1.0
CD1 D:PHE229 4.9 14.1 1.0

Chlorine binding site 5 out of 11 in 3kzl

Go back to Chlorine Binding Sites List in 3kzl
Chlorine binding site 5 out of 11 in the Crystal Structure of BA2930 Mutant (H183G) in Complex with Accoa


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 5 of Crystal Structure of BA2930 Mutant (H183G) in Complex with Accoa within 5.0Å range:
probe atom residue distance (Å) B Occ
C:Cl267

b:34.5
occ:1.00
 O C:HOH315 3.1 18.4 1.0
N C:THR31 3.2 13.0 1.0
CE2 C:TYR168 3.7 14.0 1.0
CA C:MSE30 3.7 15.1 1.0
CD2 C:TYR168 3.7 14.5 1.0
CG C:MSE30 3.9 21.4 1.0
C C:MSE30 4.0 13.9 1.0
O C:ASP166 4.0 12.1 1.0
O C:THR31 4.2 12.7 1.0
CB C:MSE30 4.2 15.6 1.0
CA C:THR31 4.2 12.4 1.0
CB C:THR31 4.2 13.0 1.0
CA C:GLY167 4.4 11.3 1.0
OG1 C:THR31 4.4 12.2 1.0
O C:LEU165 4.6 14.2 1.0
O C:GLY29 4.6 14.8 1.0
C C:THR31 4.7 12.1 1.0
C C:ASP166 4.7 12.5 1.0
N C:MSE30 4.8 14.4 1.0
N C:GLY167 4.9 12.1 1.0
CZ C:TYR168 4.9 13.9 1.0

Chlorine binding site 6 out of 11 in 3kzl

Go back to Chlorine Binding Sites List in 3kzl
Chlorine binding site 6 out of 11 in the Crystal Structure of BA2930 Mutant (H183G) in Complex with Accoa


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 6 of Crystal Structure of BA2930 Mutant (H183G) in Complex with Accoa within 5.0Å range:
probe atom residue distance (Å) B Occ
C:Cl268

b:35.6
occ:1.00
 O C:HOH497 3.0 13.7 1.0
O C:HOH318 3.1 21.9 1.0
N C:LYS244 3.2 10.9 1.0
CG C:LYS244 3.8 16.1 1.0
CA C:ALA243 3.8 11.0 1.0
CB C:LYS244 3.8 12.0 1.0
CA C:GLY173 3.9 12.6 1.0
O C:ASN242 3.9 11.3 1.0
C C:ALA243 4.0 11.1 1.0
CA C:LYS244 4.1 11.9 1.0
CB C:SER40 4.2 12.9 1.0
CD C:LYS244 4.2 19.9 1.0
O C:GLY173 4.4 13.4 1.0
C C:GLY173 4.5 12.8 1.0
O C:LYS244 4.5 10.6 1.0
CB C:ALA243 4.7 10.4 1.0
CE C:LYS244 4.7 20.7 1.0
O C:SER40 4.7 12.2 1.0
C C:ASN242 4.7 11.5 1.0
N C:ALA243 4.7 10.9 1.0
C C:LYS244 4.8 11.2 1.0
OG C:SER40 4.8 11.2 1.0
CA C:SER40 5.0 12.5 1.0

Chlorine binding site 7 out of 11 in 3kzl

Go back to Chlorine Binding Sites List in 3kzl
Chlorine binding site 7 out of 11 in the Crystal Structure of BA2930 Mutant (H183G) in Complex with Accoa


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 7 of Crystal Structure of BA2930 Mutant (H183G) in Complex with Accoa within 5.0Å range:
probe atom residue distance (Å) B Occ
C:Cl269

b:34.1
occ:1.00
 ND2 C:ASN19 3.1 13.3 1.0
CG2 C:THR16 3.8 14.2 1.0
CB C:ASN19 3.9 11.2 1.0
CA C:THR16 4.0 11.4 1.0
CG C:ASN19 4.0 13.2 1.0
CB C:THR16 4.1 11.4 1.0
O C:THR16 4.5 9.8 1.0
O C:HOH286 4.7 18.7 1.0
C C:THR16 4.8 10.7 1.0
N C:THR16 4.9 11.7 1.0

Chlorine binding site 8 out of 11 in 3kzl

Go back to Chlorine Binding Sites List in 3kzl
Chlorine binding site 8 out of 11 in the Crystal Structure of BA2930 Mutant (H183G) in Complex with Accoa


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 8 of Crystal Structure of BA2930 Mutant (H183G) in Complex with Accoa within 5.0Å range:
probe atom residue distance (Å) B Occ
C:Cl270

b:37.1
occ:1.00
 N C:LYS28 3.1 13.6 1.0
CA C:LYS27 3.7 15.6 1.0
C C:LYS27 3.9 14.4 1.0
CB C:LYS28 3.9 12.8 1.0
CA C:LYS28 4.1 12.9 1.0
NE C:ARG22 4.2 13.4 1.0
CB C:LYS27 4.2 16.4 1.0
CG C:LYS27 4.2 19.0 1.0
CD C:ARG22 4.5 13.6 1.0
O C:LEU26 4.7 14.6 1.0
O C:VAL58 4.7 9.5 1.0
N C:LYS27 4.9 14.9 1.0

Chlorine binding site 9 out of 11 in 3kzl

Go back to Chlorine Binding Sites List in 3kzl
Chlorine binding site 9 out of 11 in the Crystal Structure of BA2930 Mutant (H183G) in Complex with Accoa


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 9 of Crystal Structure of BA2930 Mutant (H183G) in Complex with Accoa within 5.0Å range:
probe atom residue distance (Å) B Occ
B:Cl268

b:39.0
occ:1.00
 N B:LYS244 3.1 12.5 1.0
O B:HOH322 3.3 2.7 0.5
OE2 D:GLU141 3.7 34.0 1.0
CA B:ALA243 3.7 11.6 1.0
O B:ASN242 3.8 10.3 1.0
C B:ALA243 3.9 12.2 1.0
CA B:GLY173 3.9 12.6 1.0
CD D:GLU141 4.1 29.5 1.0
CA B:LYS244 4.1 14.3 1.0
CB B:LYS244 4.2 15.4 1.0
CG D:GLU141 4.2 23.2 1.0
CB B:SER40 4.2 12.0 1.0
O B:LYS244 4.4 13.4 1.0
O B:GLY173 4.5 13.1 1.0
C B:GLY173 4.6 12.9 1.0
CB B:ALA243 4.6 10.9 1.0
N B:ALA243 4.6 10.8 1.0
C B:ASN242 4.6 10.3 1.0
O B:SER40 4.6 12.0 1.0
OG B:SER40 4.7 11.5 1.0
C B:LYS244 4.8 14.0 1.0
OE1 D:GLU141 4.9 28.2 1.0
O D:HOH325 4.9 11.8 0.5
O B:HOH503 4.9 19.7 1.0
N B:GLY173 5.0 12.4 1.0

Chlorine binding site 10 out of 11 in 3kzl

Go back to Chlorine Binding Sites List in 3kzl
Chlorine binding site 10 out of 11 in the Crystal Structure of BA2930 Mutant (H183G) in Complex with Accoa


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 10 of Crystal Structure of BA2930 Mutant (H183G) in Complex with Accoa within 5.0Å range:
probe atom residue distance (Å) B Occ
B:Cl270

b:32.5
occ:1.00
 O B:HOH305 2.9 11.9 1.0
O B:HOH288 3.1 9.3 1.0
N B:THR31 3.3 11.4 1.0
CA B:MSE30 3.7 14.4 1.0
CE2 B:TYR168 3.8 17.0 1.0
CG B:MSE30 3.9 21.9 1.0
CD2 B:TYR168 3.9 14.7 1.0
O B:ASP166 4.0 11.5 1.0
C B:MSE30 4.0 12.6 1.0
CB B:THR31 4.2 11.5 1.0
O B:THR31 4.3 9.8 1.0
CA B:THR31 4.3 10.7 1.0
CB B:MSE30 4.3 14.7 1.0
OG1 B:THR31 4.5 12.4 1.0
O B:GLY29 4.5 12.9 1.0
CA B:GLY167 4.6 10.4 1.0
O B:LEU165 4.7 11.6 1.0
O B:HOH299 4.7 29.4 1.0
C B:THR31 4.8 10.4 1.0
N B:MSE30 4.8 13.2 1.0
C B:ASP166 4.8 11.2 1.0

Reference:

M.M.Klimecka, M.Chruszcz, J.Font, T.Skarina, I.Shumilin, O.Onopryienko, P.J.Porebski, M.Cymborowski, M.D.Zimmerman, J.Hasseman, I.J.Glomski, L.Lebioda, A.Savchenko, A.Edwards, W.Minor. Structural Analysis of A Putative Aminoglycoside N-Acetyltransferase From Bacillus Anthracis. J.Mol.Biol. V. 410 411 2011.
ISSN: ISSN 0022-2836
PubMed: 21601576
DOI: 10.1016/J.JMB.2011.04.076
Page generated: Sat Dec 12 09:51:59 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