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Chlorine in PDB 3nrg: Crystal Structure of A Tetr Family Transcriptional Regulator (CAUR_2714) From Chloroflexus Aurantiacus J-10-Fl at 2.56 A Resolution

Protein crystallography data

The structure of Crystal Structure of A Tetr Family Transcriptional Regulator (CAUR_2714) From Chloroflexus Aurantiacus J-10-Fl at 2.56 A Resolution, PDB code: 3nrg was solved by Joint Center For Structural Genomics (Jcsg), with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 48.54 / 2.56
Space group I 41
Cell size a, b, c (Å), α, β, γ (°) 204.933, 204.933, 57.218, 90.00, 90.00, 90.00
R / Rfree (%) 20.7 / 24.3

Chlorine Binding Sites:

The binding sites of Chlorine atom in the Crystal Structure of A Tetr Family Transcriptional Regulator (CAUR_2714) From Chloroflexus Aurantiacus J-10-Fl at 2.56 A Resolution (pdb code 3nrg). This binding sites where shown within 5.0 Angstroms radius around Chlorine atom.
In total 5 binding sites of Chlorine where determined in the Crystal Structure of A Tetr Family Transcriptional Regulator (CAUR_2714) From Chloroflexus Aurantiacus J-10-Fl at 2.56 A Resolution, PDB code: 3nrg:
Jump to Chlorine binding site number: 1; 2; 3; 4; 5;

Chlorine binding site 1 out of 5 in 3nrg

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Chlorine binding site 1 out of 5 in the Crystal Structure of A Tetr Family Transcriptional Regulator (CAUR_2714) From Chloroflexus Aurantiacus J-10-Fl at 2.56 A Resolution


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 A Tetr Family Transcriptional Regulator (CAUR_2714) From Chloroflexus Aurantiacus J-10-Fl at 2.56 A Resolution within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Cl218

b:32.2
occ:1.00
N A:LEU107 3.2 28.8 1.0
N A:ARG106 3.3 28.4 1.0
C A:ASN104 3.5 29.0 1.0
CA A:ASN104 3.5 27.2 1.0
CB A:ARG106 3.6 27.1 1.0
CA A:ARG106 3.8 27.9 1.0
N A:PRO105 3.8 24.4 1.0
CG A:LEU107 3.8 34.0 1.0
CB A:ASN104 3.8 26.7 1.0
O A:ASN104 3.9 28.4 1.0
CB A:LEU107 3.9 29.2 1.0
C A:ARG106 3.9 31.6 1.0
NE A:ARG106 4.0 40.0 1.0
CA A:LEU107 4.1 28.9 1.0
CD1 A:LEU107 4.2 34.0 1.0
ND2 A:ASN104 4.2 53.3 1.0
CD1 A:LEU22 4.2 33.7 1.0
CD A:PRO105 4.3 25.7 1.0
C A:PRO105 4.3 31.1 1.0
CG A:ARG106 4.4 31.1 1.0
CG A:ASN104 4.6 59.5 1.0
NH2 A:ARG106 4.6 44.7 1.0
CA A:PRO105 4.7 24.3 1.0
CZ A:ARG106 4.8 57.5 1.0
CD A:ARG106 4.8 38.7 1.0
CD2 A:LEU22 4.9 34.9 1.0
N A:ASN104 4.9 28.4 1.0
CG A:PRO105 5.0 30.7 1.0

Chlorine binding site 2 out of 5 in 3nrg

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Chlorine binding site 2 out of 5 in the Crystal Structure of A Tetr Family Transcriptional Regulator (CAUR_2714) From Chloroflexus Aurantiacus J-10-Fl at 2.56 A Resolution


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 A Tetr Family Transcriptional Regulator (CAUR_2714) From Chloroflexus Aurantiacus J-10-Fl at 2.56 A Resolution within 5.0Å range:
probe atom residue distance (Å) B Occ
B:Cl220

b:51.8
occ:1.00
N B:LEU107 3.2 35.6 1.0
N B:ARG106 3.3 35.9 1.0
C B:ASN104 3.5 36.8 1.0
CA B:ASN104 3.6 35.1 1.0
CB B:ARG106 3.6 36.1 1.0
CA B:ARG106 3.7 35.4 1.0
N B:PRO105 3.8 33.2 1.0
CG B:LEU107 3.9 41.3 1.0
O B:ASN104 3.9 35.2 1.0
CB B:ASN104 3.9 34.7 1.0
C B:ARG106 3.9 38.5 1.0
NE B:ARG106 3.9 48.3 1.0
CB B:LEU107 3.9 36.2 1.0
CD1 B:LEU22 4.1 39.5 1.0
CA B:LEU107 4.1 36.0 1.0
CD1 B:LEU107 4.2 41.9 1.0
CD B:PRO105 4.2 35.3 1.0
C B:PRO105 4.3 38.8 1.0
CG B:ARG106 4.3 43.0 1.0
OD1 B:ASN104 4.5 39.6 1.0
NH2 B:ARG106 4.5 55.5 1.0
CA B:PRO105 4.6 32.8 1.0
CZ B:ARG106 4.7 61.9 1.0
CG B:ASN104 4.7 50.8 1.0
CD B:ARG106 4.8 49.1 1.0
CD2 B:LEU22 4.8 40.3 1.0
CG B:PRO105 4.9 39.9 1.0
CG B:LEU22 4.9 39.6 1.0
N B:ASN104 4.9 36.7 1.0

Chlorine binding site 3 out of 5 in 3nrg

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Chlorine binding site 3 out of 5 in the Crystal Structure of A Tetr Family Transcriptional Regulator (CAUR_2714) From Chloroflexus Aurantiacus J-10-Fl at 2.56 A Resolution


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 A Tetr Family Transcriptional Regulator (CAUR_2714) From Chloroflexus Aurantiacus J-10-Fl at 2.56 A Resolution within 5.0Å range:
probe atom residue distance (Å) B Occ
C:Cl221

b:47.4
occ:1.00
O C:HOH276 3.0 37.8 1.0
N C:LEU107 3.2 28.1 1.0
N C:ARG106 3.3 29.1 1.0
C C:ASN104 3.4 32.4 1.0
CA C:ASN104 3.4 30.6 1.0
CB C:ARG106 3.7 28.9 1.0
CB C:ASN104 3.7 28.3 1.0
N C:PRO105 3.7 29.1 1.0
O C:ASN104 3.8 31.0 1.0
CA C:ARG106 3.8 28.2 1.0
CB C:LEU107 4.0 27.8 1.0
C C:ARG106 4.0 30.9 1.0
CG C:LEU107 4.0 32.8 1.0
CA C:LEU107 4.2 27.7 1.0
CD C:PRO105 4.2 31.1 1.0
C C:PRO105 4.3 33.0 1.0
CD1 C:LEU107 4.3 33.1 1.0
NE C:ARG106 4.4 45.1 1.0
OD1 C:ASN104 4.5 37.9 1.0
CD1 C:LEU22 4.5 30.5 1.0
CA C:PRO105 4.6 28.6 1.0
CG C:ASN104 4.6 43.3 1.0
CG C:ARG106 4.6 34.1 1.0
N C:ASN104 4.8 32.2 1.0
CG C:PRO105 4.9 35.8 1.0
NH2 C:ARG106 4.9 46.6 1.0

Chlorine binding site 4 out of 5 in 3nrg

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Chlorine binding site 4 out of 5 in the Crystal Structure of A Tetr Family Transcriptional Regulator (CAUR_2714) From Chloroflexus Aurantiacus J-10-Fl at 2.56 A Resolution


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 A Tetr Family Transcriptional Regulator (CAUR_2714) From Chloroflexus Aurantiacus J-10-Fl at 2.56 A Resolution within 5.0Å range:
probe atom residue distance (Å) B Occ
D:Cl217

b:43.6
occ:1.00
N D:ARG106 3.3 30.2 1.0
N D:LEU107 3.4 31.3 1.0
C D:ASN104 3.5 32.2 1.0
CA D:ASN104 3.5 31.4 1.0
CB D:ARG106 3.6 30.9 1.0
N D:PRO105 3.7 28.5 1.0
NE D:ARG106 3.8 52.5 1.0
CA D:ARG106 3.8 30.4 1.0
O D:ASN104 4.0 30.6 1.0
CD D:PRO105 4.0 30.5 1.0
CB D:ASN104 4.0 31.2 1.0
C D:ARG106 4.1 34.5 1.0
CD1 D:LEU22 4.2 38.6 1.0
CG D:LEU107 4.2 37.2 1.0
CB D:LEU107 4.3 31.4 1.0
CG D:ARG106 4.3 37.8 1.0
C D:PRO105 4.3 33.4 1.0
NH2 D:ARG106 4.4 55.6 1.0
CA D:LEU107 4.4 31.2 1.0
CD1 D:LEU107 4.5 37.9 1.0
CA D:PRO105 4.5 27.9 1.0
CZ D:ARG106 4.5 64.7 1.0
CG D:PRO105 4.6 35.1 1.0
CD D:ARG106 4.6 49.0 1.0
OD1 D:ASN104 4.6 52.9 1.0
CG D:ASN104 4.8 55.8 1.0
N D:ASN104 4.8 33.0 1.0
O D:HIS103 4.9 39.9 1.0
CD2 D:LEU22 5.0 38.5 1.0

Chlorine binding site 5 out of 5 in 3nrg

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Chlorine binding site 5 out of 5 in the Crystal Structure of A Tetr Family Transcriptional Regulator (CAUR_2714) From Chloroflexus Aurantiacus J-10-Fl at 2.56 A Resolution


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 A Tetr Family Transcriptional Regulator (CAUR_2714) From Chloroflexus Aurantiacus J-10-Fl at 2.56 A Resolution within 5.0Å range:
probe atom residue distance (Å) B Occ
E:Cl219

b:54.5
occ:1.00
N E:ARG106 3.3 34.7 1.0
N E:LEU107 3.3 34.9 1.0
C E:ASN104 3.5 35.6 1.0
CA E:ASN104 3.5 33.8 1.0
CB E:ARG106 3.5 36.6 1.0
CA E:ARG106 3.8 35.2 1.0
NE E:ARG106 3.8 56.4 1.0
N E:PRO105 3.8 32.2 1.0
CB E:ASN104 3.9 34.3 1.0
O E:ASN104 4.0 34.3 1.0
C E:ARG106 4.0 39.0 1.0
CD1 E:LEU22 4.1 37.1 1.0
CG E:LEU107 4.2 38.5 1.0
CD E:PRO105 4.2 34.0 1.0
CB E:LEU107 4.2 33.7 1.0
CG E:ARG106 4.2 47.6 1.0
C E:PRO105 4.3 37.3 1.0
CA E:LEU107 4.4 34.3 1.0
NH2 E:ARG106 4.4 62.8 1.0
CD1 E:LEU107 4.5 38.3 1.0
OD1 E:ASN104 4.5 43.2 1.0
CZ E:ARG106 4.6 72.6 1.0
CA E:PRO105 4.6 32.0 1.0
CD E:ARG106 4.6 54.6 1.0
CG E:ASN104 4.7 52.2 1.0
CG E:PRO105 4.8 38.8 1.0
N E:ASN104 4.9 35.4 1.0
CD2 E:LEU22 4.9 37.0 1.0
O E:HIS103 5.0 41.7 1.0
CG E:LEU22 5.0 37.4 1.0

Reference:

Joint Center For Structural Genomics (Jcsg), Joint Center For Structural Genomics (Jcsg). N/A N/A.
Page generated: Sun Jul 21 01:09:44 2024

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