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Chlorine in PDB 3iq1: Crystal Structure of Dps Protein From Vibrio Cholerae O1, A Member of A Broad Superfamily of Ferritin-Like Diiron-Carboxylate Proteins

Protein crystallography data

The structure of Crystal Structure of Dps Protein From Vibrio Cholerae O1, A Member of A Broad Superfamily of Ferritin-Like Diiron-Carboxylate Proteins, PDB code: 3iq1 was solved by B.Nocek, S.Peterson, M.Gu, Z.Otwinowski, W.Anderson, A.Joachimiak, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 35.00 / 1.67
Space group H 3
Cell size a, b, c (Å), α, β, γ (°) 93.816, 93.816, 225.561, 90.00, 90.00, 120.00
R / Rfree (%) 13.9 / 17.4

Chlorine Binding Sites:

The binding sites of Chlorine atom in the Crystal Structure of Dps Protein From Vibrio Cholerae O1, A Member of A Broad Superfamily of Ferritin-Like Diiron-Carboxylate Proteins (pdb code 3iq1). This binding sites where shown within 5.0 Angstroms radius around Chlorine atom.
In total 4 binding sites of Chlorine where determined in the Crystal Structure of Dps Protein From Vibrio Cholerae O1, A Member of A Broad Superfamily of Ferritin-Like Diiron-Carboxylate Proteins, PDB code: 3iq1:
Jump to Chlorine binding site number: 1; 2; 3; 4;

Chlorine binding site 1 out of 4 in 3iq1

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Chlorine binding site 1 out of 4 in the Crystal Structure of Dps Protein From Vibrio Cholerae O1, A Member of A Broad Superfamily of Ferritin-Like Diiron-Carboxylate Proteins


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 Dps Protein From Vibrio Cholerae O1, A Member of A Broad Superfamily of Ferritin-Like Diiron-Carboxylate Proteins within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Cl1001

b:23.1
occ:1.00
OG A:SER81 3.1 9.2 1.0
N A:HIS80 3.2 6.6 1.0
NH1 A:ARG77 3.3 8.0 1.0
NH2 A:ARG77 3.5 8.0 1.0
N A:SER81 3.6 7.2 1.0
CA A:MSE79 3.8 6.5 1.0
O A:HOH548 3.8 24.6 1.0
CZ A:ARG77 3.9 7.9 1.0
CB A:SER81 3.9 7.6 1.0
CG A:MSE79 3.9 12.9 1.0
C A:MSE79 4.0 6.5 1.0
C A:HIS80 4.0 7.5 1.0
CB A:MSE79 4.1 8.2 1.0
CA A:HIS80 4.1 6.2 1.0
ND1 A:HIS80 4.3 6.3 1.0
CA A:SER81 4.3 6.8 1.0
CG2 D:THR95 4.5 10.3 1.0
CA A:GLY84 4.6 8.3 1.0
CG A:HIS80 4.7 6.2 1.0
CE1 A:HIS80 4.7 7.7 1.0
O A:SER81 4.7 7.6 1.0
O A:HIS80 4.8 7.2 1.0
N A:GLY84 5.0 8.2 1.0

Chlorine binding site 2 out of 4 in 3iq1

Go back to Chlorine Binding Sites List in 3iq1
Chlorine binding site 2 out of 4 in the Crystal Structure of Dps Protein From Vibrio Cholerae O1, A Member of A Broad Superfamily of Ferritin-Like Diiron-Carboxylate Proteins


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 Dps Protein From Vibrio Cholerae O1, A Member of A Broad Superfamily of Ferritin-Like Diiron-Carboxylate Proteins within 5.0Å range:
probe atom residue distance (Å) B Occ
B:Cl1001

b:23.7
occ:1.00
OG B:SER81 3.1 12.0 1.0
N B:HIS80 3.2 8.5 1.0
NH1 B:ARG77 3.3 14.3 1.0
NH2 B:ARG77 3.5 13.5 1.0
N B:SER81 3.6 9.2 1.0
CG B:MSE79 3.7 14.9 1.0
CA B:MSE79 3.8 8.0 1.0
CZ B:ARG77 3.9 12.1 1.0
CB B:SER81 3.9 9.8 1.0
C B:MSE79 4.0 8.5 1.0
O B:HOH326 4.0 25.1 1.0
C B:HIS80 4.0 10.1 1.0
CA B:HIS80 4.2 8.8 1.0
CB B:MSE79 4.2 8.6 1.0
CD2 B:HIS80 4.3 4.1 1.0
CA B:SER81 4.3 8.7 1.0
CG2 C:THR95 4.6 10.8 1.0
CA B:GLY84 4.6 9.9 1.0
CG B:HIS80 4.6 8.7 1.0
NE2 B:HIS80 4.7 11.9 1.0
O B:SER81 4.8 9.8 1.0
O B:HIS80 4.8 10.5 1.0

Chlorine binding site 3 out of 4 in 3iq1

Go back to Chlorine Binding Sites List in 3iq1
Chlorine binding site 3 out of 4 in the Crystal Structure of Dps Protein From Vibrio Cholerae O1, A Member of A Broad Superfamily of Ferritin-Like Diiron-Carboxylate Proteins


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 Dps Protein From Vibrio Cholerae O1, A Member of A Broad Superfamily of Ferritin-Like Diiron-Carboxylate Proteins within 5.0Å range:
probe atom residue distance (Å) B Occ
C:Cl1001

b:23.4
occ:1.00
O C:HOH571 3.0 31.7 1.0
OG C:SER81 3.1 8.5 1.0
N C:HIS80 3.3 8.2 1.0
NH2 C:ARG77 3.4 10.7 1.0
NH1 C:ARG77 3.5 12.6 1.0
N C:SER81 3.6 8.2 1.0
CA C:MSE79 3.8 7.7 1.0
CB C:SER81 3.9 8.6 1.0
CZ C:ARG77 3.9 11.8 1.0
O C:HOH662 4.0 19.4 1.0
C C:MSE79 4.0 8.6 1.0
C C:HIS80 4.1 8.2 1.0
CG C:MSE79 4.1 14.4 1.0
CB C:MSE79 4.1 9.5 1.0
CA C:HIS80 4.2 7.0 1.0
ND1 C:HIS80 4.3 6.5 1.0
CA C:SER81 4.3 8.3 1.0
CG2 B:THR95 4.4 8.4 1.0
CA C:GLY84 4.5 7.8 1.0
CG C:HIS80 4.7 7.1 1.0
CE1 C:HIS80 4.7 9.3 1.0
O C:SER81 4.8 7.5 1.0
O C:HIS80 4.9 9.6 1.0
N C:GLY84 5.0 7.5 1.0

Chlorine binding site 4 out of 4 in 3iq1

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Chlorine binding site 4 out of 4 in the Crystal Structure of Dps Protein From Vibrio Cholerae O1, A Member of A Broad Superfamily of Ferritin-Like Diiron-Carboxylate Proteins


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 Dps Protein From Vibrio Cholerae O1, A Member of A Broad Superfamily of Ferritin-Like Diiron-Carboxylate Proteins within 5.0Å range:
probe atom residue distance (Å) B Occ
D:Cl1001

b:23.3
occ:1.00
OG D:SER81 3.1 9.2 1.0
N D:HIS80 3.2 8.2 1.0
NH1 D:ARG77 3.4 11.1 1.0
NH2 D:ARG77 3.6 10.5 1.0
N D:SER81 3.7 8.2 1.0
CA D:MSE79 3.8 8.7 1.0
CG D:MSE79 3.8 15.3 1.0
CB D:SER81 3.9 7.1 1.0
CZ D:ARG77 3.9 8.5 1.0
O D:HOH380 4.0 20.2 1.0
C D:MSE79 4.0 8.3 1.0
C D:HIS80 4.1 8.3 1.0
CB D:MSE79 4.1 10.6 1.0
CA D:HIS80 4.2 7.2 1.0
ND1 D:HIS80 4.3 7.4 1.0
CA D:SER81 4.4 7.3 1.0
CG2 A:THR95 4.5 10.6 1.0
CA D:GLY84 4.6 9.2 1.0
CE1 D:HIS80 4.6 9.6 1.0
CG D:HIS80 4.7 6.5 1.0
O D:SER81 4.8 8.4 1.0
O D:HIS80 4.8 8.4 1.0

Reference:

B.Nocek, S.Peterson, M.Gu, Z.Otwinowski, W.Anderson, A.Joachimiak. Crystal Structure of Dps Protein From Vibrio Cholerae O1, A Member of A Broad Superfamily of Ferritin-Like Diiron-Carboxylate Proteins To Be Published.
Page generated: Sat Jul 20 21:49:06 2024

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