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Chlorine in PDB 6o6q: Crystal Structure of CKA1P, A Casein Kinase 2 Alpha Ortholog From Candida Albicans

Protein crystallography data

The structure of Crystal Structure of CKA1P, A Casein Kinase 2 Alpha Ortholog From Candida Albicans, PDB code: 6o6q was solved by P.J.Stogios, E.Evdokimova, R.Di Leo, A.Savchenko, Center For Structuralgenomics Of Infectious Diseases (Csgid), with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 34.60 / 2.70
Space group P 61 2 2
Cell size a, b, c (Å), α, β, γ (°) 125.690, 125.690, 229.719, 90.00, 90.00, 120.00
R / Rfree (%) 23.4 / 28.7

Chlorine Binding Sites:

The binding sites of Chlorine atom in the Crystal Structure of CKA1P, A Casein Kinase 2 Alpha Ortholog From Candida Albicans (pdb code 6o6q). This binding sites where shown within 5.0 Angstroms radius around Chlorine atom.
In total 8 binding sites of Chlorine where determined in the Crystal Structure of CKA1P, A Casein Kinase 2 Alpha Ortholog From Candida Albicans, PDB code: 6o6q:
Jump to Chlorine binding site number: 1; 2; 3; 4; 5; 6; 7; 8;

Chlorine binding site 1 out of 8 in 6o6q

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Chlorine binding site 1 out of 8 in the Crystal Structure of CKA1P, A Casein Kinase 2 Alpha Ortholog From Candida Albicans


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 CKA1P, A Casein Kinase 2 Alpha Ortholog From Candida Albicans within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Cl404

b:60.8
occ:1.00
 N A:GLN25 3.6 54.4 1.0
CB A:PRO24 3.6 49.9 1.0
N A:SER26 3.7 52.3 1.0
OG A:SER26 3.9 58.5 1.0
CB A:SER26 4.2 55.1 1.0
O A:HOH565 4.2 40.8 1.0
CB A:GLN25 4.2 54.1 1.0
CA A:GLN25 4.3 52.8 1.0
C A:PRO24 4.3 55.2 1.0
CA A:PRO24 4.3 55.9 1.0
C A:GLN25 4.5 51.0 1.0
CA A:SER26 4.6 51.6 1.0
CG A:PRO24 4.9 48.3 1.0

Chlorine binding site 2 out of 8 in 6o6q

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Chlorine binding site 2 out of 8 in the Crystal Structure of CKA1P, A Casein Kinase 2 Alpha Ortholog From Candida Albicans


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 CKA1P, A Casein Kinase 2 Alpha Ortholog From Candida Albicans within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Cl405

b:58.0
occ:1.00
 N A:TYR16 3.4 41.8 1.0
O A:HOH554 4.0 37.7 1.0
CA A:TYR16 4.1 34.6 1.0
CD2 A:TYR16 4.1 42.3 1.0
CA A:VAL15 4.2 43.3 1.0
C A:VAL15 4.3 41.1 1.0
CE2 A:TYR16 4.6 32.8 1.0
O A:HOH594 4.6 35.8 1.0
CB A:VAL15 4.7 45.4 1.0
CG A:TYR16 4.8 35.7 1.0

Chlorine binding site 3 out of 8 in 6o6q

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Chlorine binding site 3 out of 8 in the Crystal Structure of CKA1P, A Casein Kinase 2 Alpha Ortholog From Candida Albicans


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 CKA1P, A Casein Kinase 2 Alpha Ortholog From Candida Albicans within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Cl406

b:59.8
occ:1.00
 NH2 A:ARG66 3.1 68.7 1.0
CZ A:ARG66 4.0 59.8 1.0
NE A:ARG66 4.1 57.9 1.0
O A:LYS65 4.6 49.8 1.0

Chlorine binding site 4 out of 8 in 6o6q

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Chlorine binding site 4 out of 8 in the Crystal Structure of CKA1P, A Casein Kinase 2 Alpha Ortholog From Candida Albicans


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 CKA1P, A Casein Kinase 2 Alpha Ortholog From Candida Albicans within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Cl407

b:50.2
occ:1.00
 NE A:ARG282 3.3 81.1 1.0
N A:GLN283 3.4 30.6 1.0
CA A:ARG282 3.7 31.8 1.0
CB A:ARG282 3.9 31.4 1.0
C A:ARG282 4.0 39.7 1.0
NH2 A:ARG282 4.1 87.6 1.0
CD A:ARG282 4.1 74.5 1.0
CZ A:ARG282 4.2 84.5 1.0
OE1 A:GLN283 4.2 48.5 1.0
CB A:GLN283 4.3 36.3 1.0
CA A:GLN283 4.4 29.3 1.0
CG A:GLN283 4.4 32.2 1.0
O A:LYS281 4.6 45.5 1.0
CG A:ARG282 4.6 69.8 1.0
CD A:ARG286 4.7 55.8 1.0
CB A:ARG286 4.7 32.0 1.0
CD A:GLN283 4.8 42.3 1.0
O A:GLN283 4.8 37.4 1.0
N A:ARG282 4.9 38.7 1.0
CG A:ARG286 5.0 45.2 1.0

Chlorine binding site 5 out of 8 in 6o6q

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Chlorine binding site 5 out of 8 in the Crystal Structure of CKA1P, A Casein Kinase 2 Alpha Ortholog From Candida Albicans


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 CKA1P, A Casein Kinase 2 Alpha Ortholog From Candida Albicans within 5.0Å range:
probe atom residue distance (Å) B Occ
B:Cl402

b:56.5
occ:1.00
 CA B:PRO24 3.6 68.5 1.0
CB B:PRO24 3.6 69.1 1.0
N B:GLN25 3.7 66.1 1.0
C B:PRO24 4.2 64.6 1.0
CG B:PRO24 4.6 63.6 1.0
CB B:GLN25 4.7 71.0 1.0
CA B:GLN25 4.8 56.7 1.0
N B:PRO24 4.8 66.1 1.0

Chlorine binding site 6 out of 8 in 6o6q

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Chlorine binding site 6 out of 8 in the Crystal Structure of CKA1P, A Casein Kinase 2 Alpha Ortholog From Candida Albicans


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 CKA1P, A Casein Kinase 2 Alpha Ortholog From Candida Albicans within 5.0Å range:
probe atom residue distance (Å) B Occ
B:Cl403

b:52.8
occ:1.00
 OE2 B:GLU299 3.1 80.4 1.0
NH2 B:ARG138 3.5 34.8 1.0
NH1 B:ARG138 3.6 24.1 1.0
CB B:SER297 3.7 39.8 1.0
OG B:SER297 3.9 43.8 1.0
CZ B:ARG138 4.0 32.7 1.0
CD B:GLU299 4.0 75.7 1.0
CB B:GLU299 4.6 45.9 1.0
OE1 B:GLU299 4.6 79.2 1.0
CG B:GLU299 4.9 60.9 1.0
O3 B:GOL406 4.9 56.0 1.0
N B:GLU299 5.0 46.2 1.0

Chlorine binding site 7 out of 8 in 6o6q

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Chlorine binding site 7 out of 8 in the Crystal Structure of CKA1P, A Casein Kinase 2 Alpha Ortholog From Candida Albicans


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 CKA1P, A Casein Kinase 2 Alpha Ortholog From Candida Albicans within 5.0Å range:
probe atom residue distance (Å) B Occ
B:Cl404

b:47.2
occ:1.00
 O B:HOH554 3.4 34.2 1.0
NH2 B:ARG84 3.8 57.0 1.0
NH2 B:ARG159 4.0 46.3 1.0
NZ B:LYS81 4.2 71.5 1.0
CE B:LYS81 4.4 75.6 1.0
CB B:ASN193 4.4 62.3 1.0
NH1 B:ARG84 4.5 55.1 1.0
CD B:LYS81 4.6 76.2 1.0
ND2 B:ASN193 4.7 79.9 1.0
CZ B:ARG84 4.7 55.7 1.0
CZ B:ARG159 4.9 43.7 1.0
NH1 B:ARG159 4.9 50.5 1.0

Chlorine binding site 8 out of 8 in 6o6q

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Chlorine binding site 8 out of 8 in the Crystal Structure of CKA1P, A Casein Kinase 2 Alpha Ortholog From Candida Albicans


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 CKA1P, A Casein Kinase 2 Alpha Ortholog From Candida Albicans within 5.0Å range:
probe atom residue distance (Å) B Occ
B:Cl405

b:63.8
occ:1.00
 ND2 B:ASN280 3.4 86.9 1.0
O B:HOH539 3.5 59.8 1.0
N B:LYS281 4.1 63.0 1.0
CB B:LYS281 4.4 72.6 1.0
CG B:ASN280 4.6 88.0 1.0
CD B:LYS256 4.6 64.0 1.0
CA B:ASN280 4.8 71.7 1.0
CA B:LYS281 4.8 68.5 1.0
CB B:LYS256 4.9 55.0 1.0
C B:ASN280 4.9 64.8 1.0
CB B:ASN280 4.9 79.1 1.0

Reference:

P.J.Stogios, P.J.Stogios, E.Evdokimova, R.Di Leo, A.Savchenko, Center For Structuralgenomics Of Infectious Diseases (Csgid). N/A N/A.
Page generated: Mon Jul 29 12:32:48 2024

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