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Chlorine in PDB 3qwn: Crystal Structure of A Nigd-Like Immunity Protein (BACCAC_03262) From Bacteroides Caccae Atcc 43185 at 2.42 A Resolution

Protein crystallography data

The structure of Crystal Structure of A Nigd-Like Immunity Protein (BACCAC_03262) From Bacteroides Caccae Atcc 43185 at 2.42 A Resolution, PDB code: 3qwn 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) 29.71 / 2.42
Space group P 31
Cell size a, b, c (Å), α, β, γ (°) 132.310, 132.310, 163.350, 90.00, 90.00, 120.00
R / Rfree (%) 17.5 / 21.3

Chlorine Binding Sites:

Pages:

>>> Page 1 <<< Page 2, Binding sites: 11 - 20; Page 3, Binding sites: 21 - 30; Page 4, Binding sites: 31 - 40; Page 5, Binding sites: 41 - 41;

Binding sites:

The binding sites of Chlorine atom in the Crystal Structure of A Nigd-Like Immunity Protein (BACCAC_03262) From Bacteroides Caccae Atcc 43185 at 2.42 A Resolution (pdb code 3qwn). This binding sites where shown within 5.0 Angstroms radius around Chlorine atom.
In total 41 binding sites of Chlorine where determined in the Crystal Structure of A Nigd-Like Immunity Protein (BACCAC_03262) From Bacteroides Caccae Atcc 43185 at 2.42 A Resolution, PDB code: 3qwn:
Jump to Chlorine binding site number: 1; 2; 3; 4; 5; 6; 7; 8; 9; 10;

Chlorine binding site 1 out of 41 in 3qwn

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Chlorine binding site 1 out of 41 in the Crystal Structure of A Nigd-Like Immunity Protein (BACCAC_03262) From Bacteroides Caccae Atcc 43185 at 2.42 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 Nigd-Like Immunity Protein (BACCAC_03262) From Bacteroides Caccae Atcc 43185 at 2.42 A Resolution within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Cl238

b:81.1
occ:1.00
 OH A:TYR223 3.4 44.4 1.0
O D:SER84 3.4 42.4 1.0
O A:VAL124 3.7 34.5 1.0
CA D:ASN85 4.0 43.4 1.0
C D:SER84 4.0 42.2 1.0
CB D:ASN85 4.0 44.5 1.0
O A:HOH703 4.2 51.2 1.0
N D:ASN85 4.2 40.1 1.0
O D:HOH748 4.4 52.2 1.0
O A:HOH740 4.4 50.6 1.0
CZ A:TYR223 4.4 45.8 1.0
C A:VAL124 4.4 33.6 1.0
CE1 A:TYR223 4.6 35.7 1.0
O A:VAL123 4.7 40.5 1.0
CA A:SER125 4.7 28.8 1.0
NZ A:LYS222 4.8 91.6 1.0
N A:SER125 4.9 29.9 1.0
N D:SER84 5.0 38.9 1.0

Chlorine binding site 2 out of 41 in 3qwn

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Chlorine binding site 2 out of 41 in the Crystal Structure of A Nigd-Like Immunity Protein (BACCAC_03262) From Bacteroides Caccae Atcc 43185 at 2.42 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 Nigd-Like Immunity Protein (BACCAC_03262) From Bacteroides Caccae Atcc 43185 at 2.42 A Resolution within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Cl241

b:65.9
occ:1.00
 OH D:TYR223 3.8 41.5 1.0
O A:SER84 3.8 38.0 1.0
O D:VAL124 3.9 35.1 1.0
C A:SER84 4.0 39.8 1.0
CB A:ASN85 4.1 45.3 1.0
CA A:ASN85 4.1 44.1 1.0
N A:ASN85 4.2 40.8 1.0
C D:VAL124 4.6 34.0 1.0
O D:HOH402 4.6 42.2 1.0
O D:VAL123 4.9 33.5 1.0
N A:SER84 4.9 35.2 1.0
CZ D:TYR223 4.9 40.5 1.0
CA A:SER84 4.9 34.1 1.0
NZ D:LYS222 4.9 82.3 1.0
CB A:LEU83 5.0 38.4 1.0

Chlorine binding site 3 out of 41 in 3qwn

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Chlorine binding site 3 out of 41 in the Crystal Structure of A Nigd-Like Immunity Protein (BACCAC_03262) From Bacteroides Caccae Atcc 43185 at 2.42 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 Nigd-Like Immunity Protein (BACCAC_03262) From Bacteroides Caccae Atcc 43185 at 2.42 A Resolution within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Cl250

b:66.5
occ:1.00
 N A:TYR184 3.3 34.7 1.0
O A:HOH888 3.4 53.3 1.0
CA A:ALA183 3.7 31.7 1.0
O A:TYR184 3.9 42.9 1.0
C A:ALA183 4.0 35.9 1.0
CB A:ALA183 4.1 32.8 1.0
O A:HOH488 4.2 47.0 1.0
CD2 A:TYR184 4.2 32.6 1.0
CA A:TYR184 4.2 35.4 1.0
O A:SER98 4.3 45.6 1.0
CG2 A:VAL100 4.3 47.5 1.0
CB A:TYR184 4.4 34.7 1.0
C A:TYR184 4.5 41.7 1.0
CA A:LEU99 4.6 40.5 1.0
O A:ARG182 4.7 39.8 1.0
CG A:TYR184 4.8 33.6 1.0
N A:VAL100 4.8 45.1 1.0
N A:ALA183 5.0 33.3 1.0

Chlorine binding site 4 out of 41 in 3qwn

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Chlorine binding site 4 out of 41 in the Crystal Structure of A Nigd-Like Immunity Protein (BACCAC_03262) From Bacteroides Caccae Atcc 43185 at 2.42 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 Nigd-Like Immunity Protein (BACCAC_03262) From Bacteroides Caccae Atcc 43185 at 2.42 A Resolution within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Cl262

b:73.3
occ:1.00
 O A:HOH1205 3.0 57.7 1.0
N A:ARG75 3.3 38.6 1.0
CA A:ARG74 3.8 42.5 1.0
O A:ARG75 3.9 40.0 1.0
C A:ARG74 4.1 42.5 1.0
CB A:ARG74 4.1 41.0 1.0
CB A:ARG75 4.1 34.4 1.0
CA A:ARG75 4.2 35.7 1.0
O A:HOH319 4.3 35.8 1.0
NE A:ARG74 4.4 52.6 1.0
CG A:ARG74 4.4 42.5 1.0
O A:HOH1446 4.5 68.1 1.0
OG1 A:THR101 4.5 62.0 1.0
NH2 A:ARG74 4.5 47.6 1.0
C A:ARG75 4.5 39.7 1.0
CZ A:ARG74 4.5 63.3 1.0
CG2 A:THR101 4.6 48.7 1.0
O A:SER73 4.7 52.3 1.0
N A:ARG74 5.0 44.6 1.0

Chlorine binding site 5 out of 41 in 3qwn

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Chlorine binding site 5 out of 41 in the Crystal Structure of A Nigd-Like Immunity Protein (BACCAC_03262) From Bacteroides Caccae Atcc 43185 at 2.42 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 Nigd-Like Immunity Protein (BACCAC_03262) From Bacteroides Caccae Atcc 43185 at 2.42 A Resolution within 5.0Å range:
probe atom residue distance (Å) B Occ
B:Cl239

b:71.0
occ:1.00
 O B:HOH1051 3.3 60.1 1.0
OH B:TYR223 3.4 44.4 1.0
O C:SER84 3.6 35.0 1.0
O B:VAL124 3.8 34.2 1.0
CB C:ASN85 4.0 35.0 1.0
CA C:ASN85 4.1 35.9 1.0
C C:SER84 4.1 35.0 1.0
O B:HOH405 4.2 41.2 1.0
N C:ASN85 4.3 32.3 1.0
O B:HOH1052 4.4 58.5 1.0
CZ B:TYR223 4.4 38.6 1.0
C B:VAL124 4.5 34.0 1.0
O C:HOH335 4.6 35.5 1.0
CE1 B:TYR223 4.6 30.0 1.0
O B:VAL123 4.7 40.1 1.0
NZ B:LYS222 4.7 72.4 1.0
CA B:SER125 4.8 29.6 1.0
O C:HOH644 4.9 48.0 1.0
CE B:LYS222 4.9 66.2 1.0
N B:SER125 4.9 30.0 1.0

Chlorine binding site 6 out of 41 in 3qwn

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Chlorine binding site 6 out of 41 in the Crystal Structure of A Nigd-Like Immunity Protein (BACCAC_03262) From Bacteroides Caccae Atcc 43185 at 2.42 A Resolution


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 A Nigd-Like Immunity Protein (BACCAC_03262) From Bacteroides Caccae Atcc 43185 at 2.42 A Resolution within 5.0Å range:
probe atom residue distance (Å) B Occ
B:Cl240

b:61.0
occ:1.00
 OH C:TYR223 3.1 41.2 1.0
O B:SER84 3.3 39.3 1.0
CA B:ASN85 3.8 43.7 1.0
C B:SER84 3.8 40.3 1.0
CB B:ASN85 3.9 48.5 1.0
O C:VAL124 4.0 40.6 1.0
N B:ASN85 4.1 39.6 1.0
CZ C:TYR223 4.1 39.2 1.0
CE1 C:TYR223 4.2 34.6 1.0
O C:HOH891 4.2 55.1 1.0
O C:HOH1046 4.5 56.9 1.0
C C:VAL124 4.6 36.5 1.0
NZ C:LYS222 4.7 85.3 1.0
CE C:LYS222 4.7 69.1 1.0
O C:VAL123 4.8 31.7 1.0
CA C:SER125 4.8 31.4 1.0
N C:SER125 4.9 32.0 1.0
CA B:SER84 5.0 38.5 1.0
N B:SER84 5.0 40.0 1.0

Chlorine binding site 7 out of 41 in 3qwn

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Chlorine binding site 7 out of 41 in the Crystal Structure of A Nigd-Like Immunity Protein (BACCAC_03262) From Bacteroides Caccae Atcc 43185 at 2.42 A Resolution


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 A Nigd-Like Immunity Protein (BACCAC_03262) From Bacteroides Caccae Atcc 43185 at 2.42 A Resolution within 5.0Å range:
probe atom residue distance (Å) B Occ
B:Cl251

b:63.8
occ:1.00
 N B:TYR184 3.3 32.9 1.0
CA B:ALA183 3.6 28.9 1.0
O B:TYR184 3.9 37.0 1.0
CB B:ALA183 3.9 29.8 1.0
C B:ALA183 4.0 32.5 1.0
O B:HOH747 4.1 52.2 1.0
CG2 B:VAL100 4.3 47.1 1.0
CD2 B:TYR184 4.3 28.9 1.0
CA B:TYR184 4.3 32.1 1.0
C B:TYR184 4.6 35.8 1.0
CB B:TYR184 4.6 31.8 1.0
O B:SER98 4.6 42.2 1.0
O B:ARG182 4.7 39.7 1.0
CA B:LEU99 4.7 38.3 1.0
N B:VAL100 4.8 42.6 1.0
N B:ALA183 4.9 31.1 1.0
CG B:TYR184 4.9 30.1 1.0

Chlorine binding site 8 out of 41 in 3qwn

Go back to Chlorine Binding Sites List in 3qwn
Chlorine binding site 8 out of 41 in the Crystal Structure of A Nigd-Like Immunity Protein (BACCAC_03262) From Bacteroides Caccae Atcc 43185 at 2.42 A Resolution


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 A Nigd-Like Immunity Protein (BACCAC_03262) From Bacteroides Caccae Atcc 43185 at 2.42 A Resolution within 5.0Å range:
probe atom residue distance (Å) B Occ
B:Cl263

b:78.4
occ:1.00
 N B:ARG75 3.2 42.5 1.0
O B:HOH1084 3.8 54.8 1.0
CB B:ARG75 3.8 41.3 1.0
CA B:ARG74 3.9 46.8 1.0
O B:ARG75 3.9 40.5 1.0
CA B:ARG75 4.0 40.0 1.0
C B:ARG74 4.1 49.9 1.0
CB B:ARG74 4.3 44.0 1.0
O B:HOH470 4.3 40.2 1.0
OG1 B:THR101 4.4 58.3 1.0
C B:ARG75 4.5 40.7 1.0
CG2 B:THR101 4.5 50.0 1.0
NE B:ARG74 4.7 63.5 1.0
CG B:ARG74 4.7 49.9 1.0
O B:SER73 4.7 57.6 1.0
NH2 B:ARG74 4.8 51.8 1.0
CZ B:ARG74 4.8 63.9 1.0

Chlorine binding site 9 out of 41 in 3qwn

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Chlorine binding site 9 out of 41 in the Crystal Structure of A Nigd-Like Immunity Protein (BACCAC_03262) From Bacteroides Caccae Atcc 43185 at 2.42 A Resolution


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 A Nigd-Like Immunity Protein (BACCAC_03262) From Bacteroides Caccae Atcc 43185 at 2.42 A Resolution within 5.0Å range:
probe atom residue distance (Å) B Occ
C:Cl259

b:67.0
occ:1.00
 N C:TYR184 3.1 25.7 1.0
O C:TYR184 3.7 27.3 1.0
CA C:ALA183 3.8 23.7 1.0
C C:ALA183 3.9 28.4 1.0
CA C:TYR184 4.0 25.4 1.0
CB C:TYR184 4.0 26.3 1.0
CD2 C:TYR184 4.0 28.3 1.0
CG2 C:VAL100 4.1 33.3 1.0
C C:TYR184 4.3 27.9 1.0
CB C:ALA183 4.3 23.4 1.0
O C:SER98 4.4 37.4 1.0
CA C:LEU99 4.5 36.5 1.0
CG C:TYR184 4.5 27.1 1.0
N C:VAL100 4.8 32.7 1.0
O C:ARG182 4.8 35.9 1.0
C C:LEU99 5.0 37.7 1.0

Chlorine binding site 10 out of 41 in 3qwn

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Chlorine binding site 10 out of 41 in the Crystal Structure of A Nigd-Like Immunity Protein (BACCAC_03262) From Bacteroides Caccae Atcc 43185 at 2.42 A Resolution


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 A Nigd-Like Immunity Protein (BACCAC_03262) From Bacteroides Caccae Atcc 43185 at 2.42 A Resolution within 5.0Å range:
probe atom residue distance (Å) B Occ
C:Cl264

b:65.5
occ:1.00
 N C:ARG75 3.1 26.2 1.0
O C:HOH889 3.3 50.7 1.0
CA C:ARG74 3.7 29.5 1.0
CB C:ARG75 3.8 26.4 1.0
C C:ARG74 3.9 29.9 1.0
CA C:ARG75 4.0 26.4 1.0
O C:ARG75 4.1 27.6 1.0
CB C:ARG74 4.1 29.2 1.0
O C:HOH1079 4.3 58.4 1.0
CG2 C:THR101 4.3 29.2 1.0
O C:SER73 4.4 36.7 1.0
OG1 C:THR101 4.4 44.3 1.0
CG C:ARG74 4.4 40.3 1.0
O C:HOH307 4.5 30.9 1.0
NE C:ARG74 4.5 62.2 1.0
C C:ARG75 4.6 29.1 1.0
CZ C:ARG74 4.6 65.2 1.0
O C:HOH783 4.6 55.3 1.0
NH2 C:ARG74 4.6 50.6 1.0
N C:ARG74 4.8 31.4 1.0
CB C:THR101 4.8 40.1 1.0
OH C:TYR132 4.9 44.7 1.0

Reference:

Joint Center For Structural Genomics (Jcsg), Joint Center For Structural Genomics (Jcsg). N/A N/A.
Page generated: Sun Jul 21 03:16:48 2024

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