Atomistry » Chlorine » PDB 2x8b-2xel » 2xel
Atomistry »
  Chlorine »
    PDB 2x8b-2xel »
      2xel »

Chlorine in PDB 2xel: Molecular Mechanism of Pentachloropseudilin Mediated Inhibition of Myosin Motor Activity

Protein crystallography data

The structure of Molecular Mechanism of Pentachloropseudilin Mediated Inhibition of Myosin Motor Activity, PDB code: 2xel was solved by K.Chinthalapudi, M.H.Taft, R.Martin, F.K.Hartmann, S.M.Heissler, G.Tsiavaliaris, H.O.Gutzeit, H.J.Knoelker, L.M.Coluccio, R.Fedorov, D.J.Manstein, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 24.59 / 2.50
Space group C 2 2 21
Cell size a, b, c (Å), α, β, γ (°) 89.530, 147.490, 153.780, 90.00, 90.00, 90.00
R / Rfree (%) 22.9 / 25.3

Other elements in 2xel:

The structure of Molecular Mechanism of Pentachloropseudilin Mediated Inhibition of Myosin Motor Activity also contains other interesting chemical elements:

Magnesium (Mg) 1 atom
Vanadium (V) 1 atom

Chlorine Binding Sites:

The binding sites of Chlorine atom in the Molecular Mechanism of Pentachloropseudilin Mediated Inhibition of Myosin Motor Activity (pdb code 2xel). This binding sites where shown within 5.0 Angstroms radius around Chlorine atom.
In total 5 binding sites of Chlorine where determined in the Molecular Mechanism of Pentachloropseudilin Mediated Inhibition of Myosin Motor Activity, PDB code: 2xel:
Jump to Chlorine binding site number: 1; 2; 3; 4; 5;

Chlorine binding site 1 out of 5 in 2xel

Go back to Chlorine Binding Sites List in 2xel
Chlorine binding site 1 out of 5 in the Molecular Mechanism of Pentachloropseudilin Mediated Inhibition of Myosin Motor Activity


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 1 of Molecular Mechanism of Pentachloropseudilin Mediated Inhibition of Myosin Motor Activity within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Cl999

b:90.8
occ:0.82
CL18 A:IA2999 0.0 90.8 0.8
C10 A:IA2999 1.7 91.4 0.8
N1 A:IA2999 2.7 91.3 0.8
O A:ILE617 2.8 67.5 1.0
C9 A:IA2999 2.8 90.9 0.8
C A:ILE617 3.2 57.3 1.0
CA A:ILE617 3.2 52.4 1.0
O A:SER619 3.4 67.3 1.0
O A:ASN616 3.5 93.8 1.0
CL17 A:IA2999 3.6 90.3 0.8
N A:ILE617 3.6 56.2 1.0
C A:ASN616 3.7 68.7 1.0
CD2 A:LEU431 3.9 53.7 1.0
C7 A:IA2999 4.0 90.7 0.8
C8 A:IA2999 4.0 90.8 0.8
N A:ALA618 4.2 58.8 1.0
N A:SER619 4.4 63.1 1.0
C A:SER619 4.5 71.4 1.0
O A:PRO615 4.6 76.0 1.0
CB A:ILE617 4.6 44.6 1.0
CA A:ASN616 4.8 73.7 1.0
C A:ALA618 4.9 59.9 1.0
CA A:ALA618 4.9 61.0 1.0

Chlorine binding site 2 out of 5 in 2xel

Go back to Chlorine Binding Sites List in 2xel
Chlorine binding site 2 out of 5 in the Molecular Mechanism of Pentachloropseudilin Mediated Inhibition of Myosin Motor Activity


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 2 of Molecular Mechanism of Pentachloropseudilin Mediated Inhibition of Myosin Motor Activity within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Cl999

b:90.3
occ:0.82
CL17 A:IA2999 0.0 90.3 0.8
C9 A:IA2999 1.7 90.9 0.8
CD2 A:LEU431 2.4 53.7 1.0
C10 A:IA2999 2.8 91.4 0.8
C8 A:IA2999 2.8 90.8 0.8
CL16 A:IA2999 3.4 88.4 0.8
CG A:LEU431 3.4 50.0 1.0
CB A:LEU431 3.5 44.4 1.0
CL18 A:IA2999 3.6 90.8 0.8
N1 A:IA2999 3.9 91.3 0.8
C7 A:IA2999 4.0 90.7 0.8
CD1 A:LEU431 4.1 64.2 1.0
O A:ILE617 4.2 67.5 1.0
O A:GLY427 4.4 35.0 1.0
CA A:ARG428 4.7 36.1 1.0
CA A:ILE617 4.9 52.4 1.0
C A:GLY427 4.9 31.0 1.0
CA A:LEU431 5.0 34.3 1.0
CG A:ARG428 5.0 50.7 1.0
C A:ILE617 5.0 57.3 1.0

Chlorine binding site 3 out of 5 in 2xel

Go back to Chlorine Binding Sites List in 2xel
Chlorine binding site 3 out of 5 in the Molecular Mechanism of Pentachloropseudilin Mediated Inhibition of Myosin Motor Activity


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 3 of Molecular Mechanism of Pentachloropseudilin Mediated Inhibition of Myosin Motor Activity within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Cl999

b:88.4
occ:0.82
CL16 A:IA2999 0.0 88.4 0.8
C8 A:IA2999 1.7 90.8 0.8
C9 A:IA2999 2.8 90.9 0.8
C7 A:IA2999 2.9 90.7 0.8
O12 A:IA2999 2.9 88.8 0.8
CL17 A:IA2999 3.4 90.3 0.8
C4 A:IA2999 3.7 89.9 0.8
C3 A:IA2999 3.7 88.9 0.8
N1 A:IA2999 4.0 91.3 0.8
C A:GLY427 4.0 31.0 1.0
C10 A:IA2999 4.0 91.4 0.8
CG A:ARG428 4.0 50.7 1.0
N A:ARG428 4.0 34.3 1.0
NZ A:LYS265 4.2 52.3 1.0
CA A:GLY427 4.2 23.7 1.0
O A:GLY427 4.3 35.0 1.0
CA A:ARG428 4.5 36.1 1.0
CD A:LYS265 4.5 38.9 1.0
CE A:LYS265 4.6 45.3 1.0
O A:ALA424 4.7 38.2 1.0
NE A:ARG428 4.8 46.1 1.0
CB A:ARG428 4.9 41.8 1.0

Chlorine binding site 4 out of 5 in 2xel

Go back to Chlorine Binding Sites List in 2xel
Chlorine binding site 4 out of 5 in the Molecular Mechanism of Pentachloropseudilin Mediated Inhibition of Myosin Motor Activity


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 4 of Molecular Mechanism of Pentachloropseudilin Mediated Inhibition of Myosin Motor Activity within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Cl999

b:88.8
occ:0.82
CL13 A:IA2999 0.0 88.8 0.8
C6 A:IA2999 1.7 88.8 0.8
C1 A:IA2999 2.7 87.7 0.8
C5 A:IA2999 2.8 88.6 0.8
CB A:ARG620 3.4 73.3 1.0
NE A:ARG620 3.6 71.9 1.0
NH2 A:ARG620 4.0 58.2 1.0
O A:HOH2395 4.0 54.4 1.0
CZ A:ARG620 4.0 68.0 1.0
C2 A:IA2999 4.1 87.3 0.8
C4 A:IA2999 4.1 89.9 0.8
CG A:ARG620 4.2 75.1 1.0
O A:ALA618 4.3 60.3 1.0
CD A:ARG620 4.3 74.3 1.0
NH2 A:ARG428 4.4 36.6 1.0
N A:ARG620 4.5 67.8 1.0
CA A:ARG620 4.5 69.1 1.0
OE2 A:GLU597 4.6 53.8 1.0
C3 A:IA2999 4.7 88.9 0.8
C A:SER619 4.8 71.4 1.0

Chlorine binding site 5 out of 5 in 2xel

Go back to Chlorine Binding Sites List in 2xel
Chlorine binding site 5 out of 5 in the Molecular Mechanism of Pentachloropseudilin Mediated Inhibition of Myosin Motor Activity


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 5 of Molecular Mechanism of Pentachloropseudilin Mediated Inhibition of Myosin Motor Activity within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Cl999

b:86.6
occ:0.82
CL14 A:IA2999 0.0 86.6 0.8
C2 A:IA2999 1.7 87.3 0.8
C1 A:IA2999 2.7 87.7 0.8
C3 A:IA2999 2.8 88.9 0.8
O A:HOH2302 3.0 53.8 1.0
O12 A:IA2999 3.0 88.8 0.8
O A:ASP590 3.4 45.6 1.0
OD2 A:ASP590 3.5 31.2 1.0
O A:HOH2392 3.7 44.1 1.0
CB A:LEU592 3.8 24.7 1.0
CG A:ASP590 3.8 34.1 1.0
OD1 A:ASP590 3.8 49.8 1.0
CB A:ALA424 3.9 45.4 1.0
C6 A:IA2999 4.0 88.8 0.8
NZ A:LYS265 4.1 52.3 1.0
O A:PRO591 4.1 49.1 1.0
C4 A:IA2999 4.1 89.9 0.8
CD2 A:LEU592 4.2 21.4 1.0
C A:ASP590 4.3 38.3 1.0
C A:PRO591 4.4 32.9 1.0
CA A:ALA424 4.5 34.7 1.0
CG A:LEU592 4.6 21.0 1.0
C5 A:IA2999 4.6 88.6 0.8
N A:LEU592 4.7 34.6 1.0
CA A:LEU592 4.8 36.5 1.0
NH2 A:ARG428 4.8 36.6 1.0
NH2 A:ARG620 4.8 58.2 1.0
CB A:ASP590 4.8 28.6 1.0
O A:ALA420 4.8 33.8 1.0

Reference:

K.Chinthalapudi, M.H.Taft, R.Martin, S.M.Heissler, M.Preller, F.K.Hartmann, H.Brandstaetter, J.Kendrick-Jones, G.Tsiavaliaris, H.O.Gutzeit, R.Fedorov, F.Buss, H.J.Knoelker, L.M.Coluccio, D.J.Manstein. Mechanism and Specificity of Pentachloropseudilin- Mediated Inhibition of Myosin Motor Activity. J.Biol.Chem. V. 286 29700 2011.
ISSN: ISSN 0021-9258
PubMed: 21680745
DOI: 10.1074/JBC.M111.239210
Page generated: Sat Dec 12 09:25:42 2020

Last articles

Zn in 7VD8
Zn in 7V1R
Zn in 7V1Q
Zn in 7VPF
Zn in 7T85
Zn in 7T5F
Zn in 7NF9
Zn in 7M4M
Zn in 7M4O
Zn in 7M4N
© Copyright 2008-2020 by atomistry.com
Home   |    Site Map   |    Copyright   |    Contact us   |    Privacy