Chlorine in PDB 2wpr: Salmonella Enterica Sada 483-523 Fused to GCN4 Adaptors ( SADAK3B-V1, Out-of-Register Fusion)

Protein crystallography data

The structure of Salmonella Enterica Sada 483-523 Fused to GCN4 Adaptors ( SADAK3B-V1, Out-of-Register Fusion), PDB code: 2wpr was solved by M.D.Hartmann, O.Ridderbusch, A.N.Lupas, B.Hernandez Alvarez, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 35.36 / 2.65
Space group P 21 21 21
Cell size a, b, c (Å), α, β, γ (°) 36.130, 62.530, 172.570, 90.00, 90.00, 90.00
R / Rfree (%) 26.704 / 32.729

Chlorine Binding Sites:

The binding sites of Chlorine atom in the Salmonella Enterica Sada 483-523 Fused to GCN4 Adaptors ( SADAK3B-V1, Out-of-Register Fusion) (pdb code 2wpr). This binding sites where shown within 5.0 Angstroms radius around Chlorine atom.
In total 4 binding sites of Chlorine where determined in the Salmonella Enterica Sada 483-523 Fused to GCN4 Adaptors ( SADAK3B-V1, Out-of-Register Fusion), PDB code: 2wpr:
Jump to Chlorine binding site number: 1; 2; 3; 4;

Chlorine binding site 1 out of 4 in 2wpr

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Chlorine binding site 1 out of 4 in the Salmonella Enterica Sada 483-523 Fused to GCN4 Adaptors ( SADAK3B-V1, Out-of-Register Fusion)


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 1 of Salmonella Enterica Sada 483-523 Fused to GCN4 Adaptors ( SADAK3B-V1, Out-of-Register Fusion) within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Cl1554

b:43.8
occ:1.00
ND2 C:ASN495 3.0 33.3 1.0
ND2 B:ASN495 3.1 33.4 1.0
ND2 A:ASN495 3.1 33.6 1.0
CB C:ASN495 3.6 24.7 1.0
CB A:ASN495 3.7 24.9 1.0
CB B:ASN495 3.8 25.3 1.0
CG C:ASN495 3.8 34.0 1.0
CG A:ASN495 3.9 33.9 1.0
CG B:ASN495 3.9 34.0 1.0
CG2 A:ILE492 4.3 28.1 1.0
CG1 C:ILE492 4.3 38.1 1.0
CA C:ILE492 4.3 32.7 1.0
CG2 B:ILE492 4.4 28.3 1.0
CG1 A:ILE492 4.4 37.8 1.0
CG1 B:ILE492 4.4 38.2 1.0
CA A:ILE492 4.4 32.7 1.0
CG2 C:ILE492 4.4 28.1 1.0
CA B:ILE492 4.5 32.4 1.0
CB A:ILE492 4.6 30.1 1.0
CB C:ILE492 4.6 30.3 1.0
CB B:ILE492 4.7 30.1 1.0
O C:ILE492 4.8 30.0 1.0
O A:ILE492 4.9 30.4 1.0
O C:ASP491 5.0 29.5 1.0

Chlorine binding site 2 out of 4 in 2wpr

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Chlorine binding site 2 out of 4 in the Salmonella Enterica Sada 483-523 Fused to GCN4 Adaptors ( SADAK3B-V1, Out-of-Register Fusion)


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 2 of Salmonella Enterica Sada 483-523 Fused to GCN4 Adaptors ( SADAK3B-V1, Out-of-Register Fusion) within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Cl1555

b:48.6
occ:1.00
ND2 A:ASN509 3.1 21.8 1.0
ND2 C:ASN509 3.3 20.8 1.0
ND2 B:ASN509 3.4 20.6 1.0
CB A:ASN509 3.4 33.6 1.0
CB B:ASN509 3.6 33.8 1.0
CB C:ASN509 3.7 33.9 1.0
CG A:ASN509 3.7 35.6 1.0
CG C:ASN509 3.9 35.7 1.0
CG B:ASN509 4.0 36.1 1.0
CA A:ILE506 4.2 34.7 1.0
CA B:ILE506 4.4 34.5 1.0
CA C:ILE506 4.5 34.5 1.0
CG2 A:ILE506 4.5 30.9 1.0
CG1 A:ILE506 4.6 45.1 1.0
CG2 B:ILE506 4.7 31.0 1.0
CB A:ILE506 4.7 38.6 1.0
CG1 B:ILE506 4.7 44.5 1.0
CG2 C:ILE506 4.8 31.1 1.0
CG1 C:ILE506 4.8 44.6 1.0
O A:ILE506 4.8 33.3 1.0
CA A:ASN509 4.8 31.9 1.0
CB B:ILE506 4.8 38.3 1.0
O A:ASP505 4.9 35.2 1.0
O B:ILE506 4.9 32.5 1.0
CB C:ILE506 4.9 38.5 1.0
OD1 A:ASN509 4.9 44.2 1.0
N A:ILE506 5.0 33.2 1.0

Chlorine binding site 3 out of 4 in 2wpr

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Chlorine binding site 3 out of 4 in the Salmonella Enterica Sada 483-523 Fused to GCN4 Adaptors ( SADAK3B-V1, Out-of-Register Fusion)


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 3 of Salmonella Enterica Sada 483-523 Fused to GCN4 Adaptors ( SADAK3B-V1, Out-of-Register Fusion) within 5.0Å range:
probe atom residue distance (Å) B Occ
B:Cl1554

b:42.6
occ:1.00
ND2 C:ASN488 3.4 40.7 1.0
ND2 B:ASN488 3.4 40.2 1.0
ND2 A:ASN488 3.6 40.1 1.0
CB C:ASN488 3.7 31.3 1.0
CB B:ASN488 4.0 31.4 1.0
CB A:ASN488 4.0 30.7 1.0
CG C:ASN488 4.1 35.4 1.0
CA C:VAL485 4.1 35.1 1.0
CG2 C:VAL485 4.2 33.9 1.0
CG B:ASN488 4.2 35.0 1.0
CG2 A:VAL485 4.2 33.4 1.0
O C:VAL485 4.3 41.9 1.0
CG A:ASN488 4.3 35.2 1.0
CG2 B:VAL485 4.3 33.4 1.0
CA A:VAL485 4.4 34.9 1.0
CG1 C:VAL485 4.4 34.4 1.0
CB C:VAL485 4.5 32.3 1.0
CA B:VAL485 4.5 34.8 1.0
CG1 A:VAL485 4.6 34.2 1.0
CB A:VAL485 4.6 32.7 1.0
C C:VAL485 4.7 37.5 1.0
CG1 B:VAL485 4.8 34.5 1.0
CB B:VAL485 4.8 32.5 1.0
O C:LYS484 4.8 42.6 1.0
O A:VAL485 4.8 41.5 1.0

Chlorine binding site 4 out of 4 in 2wpr

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Chlorine binding site 4 out of 4 in the Salmonella Enterica Sada 483-523 Fused to GCN4 Adaptors ( SADAK3B-V1, Out-of-Register Fusion)


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 4 of Salmonella Enterica Sada 483-523 Fused to GCN4 Adaptors ( SADAK3B-V1, Out-of-Register Fusion) within 5.0Å range:
probe atom residue distance (Å) B Occ
B:Cl1555

b:57.5
occ:1.00
ND2 B:ASN502 3.1 26.0 1.0
ND2 A:ASN502 3.3 25.8 1.0
ND2 C:ASN502 3.4 25.7 1.0
CB B:ASN502 3.6 27.2 1.0
CB C:ASN502 3.6 27.3 1.0
CG B:ASN502 3.8 37.7 1.0
CB A:ASN502 3.9 27.1 1.0
CG C:ASN502 4.0 37.6 1.0
CG A:ASN502 4.1 37.7 1.0
CA C:ILE499 4.2 31.2 1.0
CG1 C:ILE499 4.2 37.2 1.0
CG1 B:ILE499 4.3 37.5 1.0
CA B:ILE499 4.4 30.8 1.0
CG1 A:ILE499 4.5 37.0 1.0
O C:ILE499 4.6 30.9 1.0
CB C:ILE499 4.6 31.5 1.0
CG2 C:ILE499 4.7 25.8 1.0
CA A:ILE499 4.7 31.0 1.0
CG2 B:ILE499 4.7 26.1 1.0
CB B:ILE499 4.8 31.4 1.0
O B:ILE499 4.8 30.7 1.0
CG2 A:ILE499 4.9 26.4 1.0
O C:SER498 4.9 36.0 1.0
OD1 B:ASN502 5.0 31.1 1.0
C C:ILE499 5.0 29.5 1.0
CB A:ILE499 5.0 31.8 1.0

Reference:

M.D.Hartmann, O.Ridderbusch, K.Zeth, R.Albrecht, O.Testa, D.N.Woolfson, G.Sauer, S.Dunin-Horkawicz, A.N.Lupas, B.H.Alvarez. A Coiled-Coil Motif That Sequesters Ions to the Hydrophobic Core. Proc.Natl.Acad.Sci.Usa V. 106 16950 2009.
ISSN: ISSN 0027-8424
PubMed: 19805097
DOI: 10.1073/PNAS.0907256106
Page generated: Sat Jul 20 13:12:44 2024

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