Atomistry » Chlorine » PDB 3rmn-3ruu » 3roi
Atomistry »
  Chlorine »
    PDB 3rmn-3ruu »
      3roi »

Chlorine in PDB 3roi: 2.20 Angstrom Resolution Structure of 3-Phosphoshikimate 1- Carboxyvinyltransferase (Aroa) From Coxiella Burnetii

Enzymatic activity of 2.20 Angstrom Resolution Structure of 3-Phosphoshikimate 1- Carboxyvinyltransferase (Aroa) From Coxiella Burnetii

All present enzymatic activity of 2.20 Angstrom Resolution Structure of 3-Phosphoshikimate 1- Carboxyvinyltransferase (Aroa) From Coxiella Burnetii:
2.5.1.19;

Protein crystallography data

The structure of 2.20 Angstrom Resolution Structure of 3-Phosphoshikimate 1- Carboxyvinyltransferase (Aroa) From Coxiella Burnetii, PDB code: 3roi was solved by S.H.Light, G.Minasov, S.N.Krishna, A.S.Halavaty, L.Shuvalova, L.Papazisi, W.F.Anderson, Center For Structural Genomics Of Infectious Diseases(Csgid), with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 29.10 / 2.20
Space group P 21 21 21
Cell size a, b, c (Å), α, β, γ (°) 42.164, 116.408, 160.749, 90.00, 90.00, 90.00
R / Rfree (%) 19.1 / 24.3

Chlorine Binding Sites:

The binding sites of Chlorine atom in the 2.20 Angstrom Resolution Structure of 3-Phosphoshikimate 1- Carboxyvinyltransferase (Aroa) From Coxiella Burnetii (pdb code 3roi). This binding sites where shown within 5.0 Angstroms radius around Chlorine atom.
In total 4 binding sites of Chlorine where determined in the 2.20 Angstrom Resolution Structure of 3-Phosphoshikimate 1- Carboxyvinyltransferase (Aroa) From Coxiella Burnetii, PDB code: 3roi:
Jump to Chlorine binding site number: 1; 2; 3; 4;

Chlorine binding site 1 out of 4 in 3roi

Go back to Chlorine Binding Sites List in 3roi
Chlorine binding site 1 out of 4 in the 2.20 Angstrom Resolution Structure of 3-Phosphoshikimate 1- Carboxyvinyltransferase (Aroa) From Coxiella Burnetii


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 1 of 2.20 Angstrom Resolution Structure of 3-Phosphoshikimate 1- Carboxyvinyltransferase (Aroa) From Coxiella Burnetii within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Cl439

b:37.7
occ:1.00
ND2 A:ASN70 3.2 37.8 1.0
N A:MET45 3.5 31.1 1.0
N A:ASN417 3.5 35.5 1.0
CD A:PRO416 3.6 35.6 1.0
CD2 A:PHE415 3.7 36.7 1.0
CB A:ASN417 3.7 35.0 1.0
CG A:PRO416 3.8 37.1 1.0
CB A:MET45 3.8 33.2 1.0
CG A:PRO18 3.8 33.3 1.0
ND2 A:ASN417 3.8 37.4 1.0
CG A:ASN417 3.8 38.1 1.0
N A:PRO416 3.9 34.4 1.0
CD1 A:LEU44 3.9 29.0 1.0
CA A:MET45 4.1 31.6 1.0
CE2 A:PHE415 4.1 37.0 1.0
CA A:ASN417 4.2 34.8 1.0
C A:PHE415 4.2 34.8 1.0
CG A:ASN70 4.2 36.5 1.0
CA A:PHE415 4.3 34.5 1.0
OD1 A:ASN70 4.4 37.8 1.0
C A:PRO416 4.5 36.3 1.0
CG A:MET45 4.5 33.9 1.0
C A:LEU44 4.5 31.2 1.0
OD1 A:ASN417 4.5 40.6 1.0
CB A:PRO18 4.5 33.5 1.0
CA A:PRO416 4.5 35.0 1.0
C A:MET45 4.5 31.9 1.0
CA A:LEU44 4.6 29.9 1.0
CB A:PRO416 4.6 36.9 1.0
N A:GLY46 4.7 31.1 1.0
CG A:PHE415 4.8 34.6 1.0
CD A:PRO18 4.8 34.0 1.0
CG A:LEU44 4.9 32.3 1.0
O A:PHE415 4.9 34.7 1.0

Chlorine binding site 2 out of 4 in 3roi

Go back to Chlorine Binding Sites List in 3roi
Chlorine binding site 2 out of 4 in the 2.20 Angstrom Resolution Structure of 3-Phosphoshikimate 1- Carboxyvinyltransferase (Aroa) From Coxiella Burnetii


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 2 of 2.20 Angstrom Resolution Structure of 3-Phosphoshikimate 1- Carboxyvinyltransferase (Aroa) From Coxiella Burnetii within 5.0Å range:
probe atom residue distance (Å) B Occ
B:Cl439

b:42.5
occ:1.00
ND2 B:ASN70 3.2 41.4 1.0
N B:ASN417 3.4 46.7 1.0
N B:MET45 3.5 35.7 1.0
CD B:PRO416 3.6 48.3 1.0
CD2 B:PHE415 3.6 48.2 1.0
CB B:ASN417 3.6 44.9 1.0
CG B:PRO416 3.7 51.8 1.0
CG B:ASN417 3.7 49.7 1.0
ND2 B:ASN417 3.8 51.1 1.0
CB B:MET45 3.8 37.2 1.0
N B:PRO416 3.9 47.9 1.0
CG B:PRO18 3.9 42.3 1.0
CD1 B:LEU44 4.0 31.0 1.0
CE2 B:PHE415 4.0 46.3 1.0
CA B:MET45 4.1 36.9 1.0
CA B:ASN417 4.1 45.3 1.0
C B:PHE415 4.2 46.1 1.0
OD1 B:ASN417 4.3 51.8 1.0
CG B:ASN70 4.3 41.9 1.0
CA B:PHE415 4.3 46.4 1.0
CG B:MET45 4.4 35.6 1.0
C B:PRO416 4.4 47.5 1.0
CA B:PRO416 4.5 48.4 1.0
CB B:PRO416 4.5 51.7 1.0
C B:LEU44 4.5 35.1 1.0
OD1 B:ASN70 4.6 45.0 1.0
CB B:PRO18 4.6 39.5 1.0
C B:MET45 4.6 36.8 1.0
CA B:LEU44 4.6 35.3 1.0
CG B:PHE415 4.8 45.4 1.0
N B:GLY46 4.9 37.7 1.0
O B:PHE415 4.9 45.5 1.0
CG B:LEU44 4.9 35.8 1.0

Chlorine binding site 3 out of 4 in 3roi

Go back to Chlorine Binding Sites List in 3roi
Chlorine binding site 3 out of 4 in the 2.20 Angstrom Resolution Structure of 3-Phosphoshikimate 1- Carboxyvinyltransferase (Aroa) From Coxiella Burnetii


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 3 of 2.20 Angstrom Resolution Structure of 3-Phosphoshikimate 1- Carboxyvinyltransferase (Aroa) From Coxiella Burnetii within 5.0Å range:
probe atom residue distance (Å) B Occ
B:Cl440

b:73.5
occ:0.50
O B:ARG194 3.3 70.0 1.0
N B:HIS196 3.4 61.1 1.0
OG B:SER172 3.5 49.7 1.0
OG1 B:THR197 3.5 47.8 1.0
N B:THR197 3.6 50.4 1.0
C B:ARG194 3.8 70.8 1.0
NH2 B:ARG26 3.9 43.1 1.0
NE B:ARG26 3.9 41.2 1.0
CA B:HIS196 4.1 58.5 1.0
CB B:HIS196 4.1 59.2 1.0
CB B:ARG194 4.1 73.1 1.0
CZ B:ARG26 4.2 42.5 1.0
N B:ASP195 4.2 69.6 1.0
C B:ASP195 4.2 64.6 1.0
CB B:THR197 4.3 46.0 1.0
C B:HIS196 4.3 54.5 1.0
CA B:ASP195 4.4 67.3 1.0
CB B:ALA168 4.4 57.1 1.0
CA B:THR197 4.6 47.5 1.0
CA B:ARG194 4.6 72.8 1.0
OE2 B:GLU198 4.6 59.9 1.0
O B:ALA168 4.6 55.0 1.0
ND1 B:HIS196 4.8 65.0 1.0
CD B:ARG26 4.9 37.6 1.0
CB B:SER172 4.9 43.0 1.0
CG B:HIS196 4.9 63.1 1.0

Chlorine binding site 4 out of 4 in 3roi

Go back to Chlorine Binding Sites List in 3roi
Chlorine binding site 4 out of 4 in the 2.20 Angstrom Resolution Structure of 3-Phosphoshikimate 1- Carboxyvinyltransferase (Aroa) From Coxiella Burnetii


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 4 of 2.20 Angstrom Resolution Structure of 3-Phosphoshikimate 1- Carboxyvinyltransferase (Aroa) From Coxiella Burnetii within 5.0Å range:
probe atom residue distance (Å) B Occ
B:Cl441

b:96.3
occ:1.00
OG B:SER167 3.5 60.2 1.0
N B:ALA168 3.6 57.3 1.0
CA B:SER167 3.7 57.7 1.0
CG B:GLN169 3.9 56.7 1.0
C B:SER167 4.0 56.6 1.0
CB B:SER167 4.0 58.3 1.0
CD B:GLN169 4.1 60.6 1.0
N B:GLN169 4.1 54.2 1.0
NE2 B:GLN169 4.3 62.5 1.0
CB B:GLN169 4.4 53.1 1.0
CA B:ALA168 4.6 56.4 1.0
OE1 B:GLN169 4.7 63.6 1.0
CB B:ALA168 4.7 57.1 1.0
O B:ALA166 4.8 59.9 1.0
NH1 B:ARG194 4.8 79.1 1.0
N B:SER167 4.9 57.7 1.0
C B:ALA168 4.9 54.7 1.0
NH2 B:ARG194 4.9 82.8 1.0
CA B:GLN169 5.0 52.0 1.0
O B:SER167 5.0 55.1 1.0

Reference:

S.H.Light, G.Minasov, S.N.Krishna, A.S.Halavaty, L.Shuvalova, L.Papazisi, W.F.Anderson, Center For Structural Genomics Of Infectious Diseases(Csgid). 2.20 Angstrom Resolution Structure of 3-Phosphoshikimate 1-Carboxyvinyltransferase (Aroa) From Coxiella Burnetii To Be Published.
Page generated: Fri Jul 11 09:55:59 2025

Last articles

Cl in 3TXI
Cl in 3TXJ
Cl in 3TXH
Cl in 3TXF
Cl in 3TXE
Cl in 3TXD
Cl in 3TXB
Cl in 3TW9
Cl in 3TX8
Cl in 3TX3
© Copyright 2008-2020 by atomistry.com
Home   |    Site Map   |    Copyright   |    Contact us   |    Privacy