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Chlorine in PDB 3iv1: Coiled-Coil Domain of Tumor Susceptibility Gene 101

Protein crystallography data

The structure of Coiled-Coil Domain of Tumor Susceptibility Gene 101, PDB code: 3iv1 was solved by D.Neculai, G.V.Avvakumov, A.K.Wernimont, S.Xue, J.R.Walker, Y.Li, J.Weigelt, C.Bountra, C.H.Arrowsmith, A.M.Edwards, A.Bochkarev, S.Dhe-Paganon, Structural Genomics Consortium (Sgc), with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 48.75 / 2.50
Space group P 32 2 1
Cell size a, b, c (Å), α, β, γ (°) 56.290, 56.290, 341.850, 90.00, 90.00, 120.00
R / Rfree (%) 22.8 / 27.7

Chlorine Binding Sites:

Pages:

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

Binding sites:

The binding sites of Chlorine atom in the Coiled-Coil Domain of Tumor Susceptibility Gene 101 (pdb code 3iv1). This binding sites where shown within 5.0 Angstroms radius around Chlorine atom.
In total 11 binding sites of Chlorine where determined in the Coiled-Coil Domain of Tumor Susceptibility Gene 101, PDB code: 3iv1:
Jump to Chlorine binding site number: 1; 2; 3; 4; 5; 6; 7; 8; 9; 10;

Chlorine binding site 1 out of 11 in 3iv1

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Chlorine binding site 1 out of 11 in the Coiled-Coil Domain of Tumor Susceptibility Gene 101


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 1 of Coiled-Coil Domain of Tumor Susceptibility Gene 101 within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Cl602

b:61.8
occ:1.00
N A:GLY227 3.8 49.2 1.0
CA A:GLY227 4.1 48.5 1.0

Chlorine binding site 2 out of 11 in 3iv1

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Chlorine binding site 2 out of 11 in the Coiled-Coil Domain of Tumor Susceptibility Gene 101


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 2 of Coiled-Coil Domain of Tumor Susceptibility Gene 101 within 5.0Å range:
probe atom residue distance (Å) B Occ
B:Cl602

b:53.3
occ:1.00
OG B:SER300 3.4 47.0 1.0
NZ B:LYS304 3.4 85.3 1.0
CA B:SER300 4.1 29.5 1.0
CB B:SER300 4.1 34.1 1.0
CE B:LYS304 4.6 78.3 1.0
CD B:LYS304 4.6 77.3 1.0
N B:SER300 4.7 27.7 1.0

Chlorine binding site 3 out of 11 in 3iv1

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Chlorine binding site 3 out of 11 in the Coiled-Coil Domain of Tumor Susceptibility Gene 101


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 3 of Coiled-Coil Domain of Tumor Susceptibility Gene 101 within 5.0Å range:
probe atom residue distance (Å) B Occ
C:Cl601

b:57.8
occ:1.00
OG C:SER235 3.4 45.1 1.0
OG B:SER235 3.7 31.6 1.0
O B:SER235 3.7 23.4 1.0
O C:SER235 3.8 27.3 1.0
NE B:ARG239 3.9 38.1 1.0
CD2 C:LEU238 4.2 14.2 1.0
CG B:ARG239 4.2 24.8 1.0
CB B:ARG239 4.2 18.4 1.0
NH1 C:ARG239 4.4 17.4 1.0
N B:ARG239 4.5 19.0 1.0
CB C:SER235 4.5 28.9 1.0
CA C:SER235 4.5 25.2 1.0
C C:SER235 4.5 28.3 1.0
C B:SER235 4.5 24.1 1.0
CA B:ARG239 4.6 20.2 1.0
CD B:ARG239 4.6 23.7 1.0
CE B:MSE242 4.6 42.0 1.0
SE B:MSE242 4.6 46.1 1.0
CG C:LEU238 4.7 17.8 1.0
CD C:ARG239 4.7 19.4 1.0
CD2 B:LEU238 4.7 22.2 1.0
CB C:LEU238 4.7 14.2 1.0
NH2 B:ARG239 4.8 48.6 1.0
CZ B:ARG239 4.8 42.6 1.0
CB B:SER235 4.8 24.3 1.0
CA B:SER235 4.8 20.6 1.0
CG C:ARG239 4.9 20.9 1.0
CG B:LEU238 4.9 19.5 1.0
N C:ARG239 5.0 15.0 1.0
CB B:LEU238 5.0 15.0 1.0

Chlorine binding site 4 out of 11 in 3iv1

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Chlorine binding site 4 out of 11 in the Coiled-Coil Domain of Tumor Susceptibility Gene 101


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 4 of Coiled-Coil Domain of Tumor Susceptibility Gene 101 within 5.0Å range:
probe atom residue distance (Å) B Occ
C:Cl305

b:58.5
occ:1.00
NZ C:LYS304 3.3 90.9 1.0
CA C:SER300 4.2 35.1 1.0
CB C:SER300 4.2 41.0 1.0
CD C:LYS304 4.5 82.1 1.0
CE C:LYS304 4.5 82.8 1.0
N C:SER300 4.9 33.2 1.0

Chlorine binding site 5 out of 11 in 3iv1

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Chlorine binding site 5 out of 11 in the Coiled-Coil Domain of Tumor Susceptibility Gene 101


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 5 of Coiled-Coil Domain of Tumor Susceptibility Gene 101 within 5.0Å range:
probe atom residue distance (Å) B Occ
D:Cl601

b:57.4
occ:1.00
OG D:SER235 3.5 37.8 1.0
O A:SER235 3.7 23.0 1.0
OG A:SER235 3.7 35.9 1.0
O D:SER235 3.9 20.7 1.0
NE A:ARG239 4.1 43.1 1.0
CG A:ARG239 4.2 29.3 1.0
CB A:ARG239 4.3 19.0 1.0
CD2 D:LEU238 4.3 22.0 1.0
N A:ARG239 4.4 17.4 1.0
CE A:MSE242 4.4 43.3 1.0
NE D:ARG239 4.5 37.5 1.0
CD2 A:LEU238 4.5 21.6 1.0
SE A:MSE242 4.5 46.3 1.0
CA A:ARG239 4.6 18.8 1.0
C A:SER235 4.6 24.6 1.0
CG D:ARG239 4.6 26.3 1.0
C D:SER235 4.6 22.1 1.0
CB D:SER235 4.6 26.1 1.0
CD A:ARG239 4.7 36.2 1.0
CA D:SER235 4.7 22.1 1.0
CG A:LEU238 4.7 18.9 1.0
CG D:LEU238 4.8 21.9 1.0
CB D:LEU238 4.8 17.3 1.0
CA A:SER235 4.8 22.5 1.0
CB A:LEU238 4.8 14.6 1.0
CB A:SER235 4.9 25.7 1.0
N D:ARG239 4.9 19.8 1.0
CB D:ARG239 4.9 17.4 1.0
NH2 A:ARG239 4.9 54.5 1.0
CZ A:ARG239 4.9 49.9 1.0

Chlorine binding site 6 out of 11 in 3iv1

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Chlorine binding site 6 out of 11 in the Coiled-Coil Domain of Tumor Susceptibility Gene 101


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 6 of Coiled-Coil Domain of Tumor Susceptibility Gene 101 within 5.0Å range:
probe atom residue distance (Å) B Occ
D:Cl602

b:55.1
occ:1.00
NZ D:LYS304 3.7 63.7 1.0
CB D:SER300 4.3 41.0 1.0
CA D:SER300 4.4 35.6 1.0
CD D:LYS304 4.7 68.1 1.0
CE D:LYS304 4.8 60.1 1.0

Chlorine binding site 7 out of 11 in 3iv1

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Chlorine binding site 7 out of 11 in the Coiled-Coil Domain of Tumor Susceptibility Gene 101


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 7 of Coiled-Coil Domain of Tumor Susceptibility Gene 101 within 5.0Å range:
probe atom residue distance (Å) B Occ
E:Cl601

b:44.7
occ:1.00
OG E:SER235 3.1 35.8 1.0
O E:SER235 3.3 25.5 1.0
CD2 E:LEU238 3.7 22.5 1.0
CA E:SER235 3.9 23.0 1.0
C E:SER235 4.0 25.8 1.0
CB E:SER235 4.0 26.4 1.0
CB E:LEU238 4.2 15.6 1.0
CG E:LEU238 4.2 20.2 1.0
N E:ARG239 4.6 18.1 1.0
CG1 F:VAL284 4.7 20.6 1.0
CE E:MSE242 4.8 42.9 1.0
NE E:ARG239 4.9 35.5 1.0

Chlorine binding site 8 out of 11 in 3iv1

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Chlorine binding site 8 out of 11 in the Coiled-Coil Domain of Tumor Susceptibility Gene 101


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 8 of Coiled-Coil Domain of Tumor Susceptibility Gene 101 within 5.0Å range:
probe atom residue distance (Å) B Occ
E:Cl602

b:48.2
occ:1.00
NZ E:LYS304 3.2 81.4 1.0
OG E:SER300 3.4 46.9 1.0
CA E:SER300 4.1 30.2 1.0
CB E:SER300 4.2 34.8 1.0
CE E:LYS304 4.4 75.4 1.0
CD E:LYS304 4.4 78.2 1.0
N E:SER300 4.7 28.9 1.0

Chlorine binding site 9 out of 11 in 3iv1

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Chlorine binding site 9 out of 11 in the Coiled-Coil Domain of Tumor Susceptibility Gene 101


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 9 of Coiled-Coil Domain of Tumor Susceptibility Gene 101 within 5.0Å range:
probe atom residue distance (Å) B Occ
F:Cl601

b:60.1
occ:1.00
OG F:SER300 3.7 50.3 1.0
NZ F:LYS304 3.7 61.1 1.0
CA F:SER300 4.4 33.5 1.0
CB F:SER300 4.5 37.8 1.0
CD F:LYS304 4.6 58.0 1.0
CE F:LYS304 4.8 52.0 1.0
N F:SER300 4.9 32.4 1.0

Chlorine binding site 10 out of 11 in 3iv1

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Chlorine binding site 10 out of 11 in the Coiled-Coil Domain of Tumor Susceptibility Gene 101


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 10 of Coiled-Coil Domain of Tumor Susceptibility Gene 101 within 5.0Å range:
probe atom residue distance (Å) B Occ
G:Cl601

b:51.0
occ:1.00
NZ G:LYS304 3.4 65.7 1.0
CB G:SER300 4.3 42.2 1.0
CA G:SER300 4.3 35.8 1.0
CD G:LYS304 4.5 63.0 1.0
CE G:LYS304 4.6 60.6 1.0
N G:SER300 5.0 34.3 1.0

Reference:

D.Neculai, G.V.Avvakumov, A.K.Wernimont, S.Xue, J.R.Walker, Y.Li, J.Weigelt, C.Bountra, C.H.Arrowsmith, A.M.Edwards, A.Bochkarev, S.Dhe-Paganon. Coiled-Coil Domain of Human TSG101 To Be Published.
Page generated: Sat Jul 20 21:58:52 2024

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