Atomistry » Chlorine » PDB 2bwv-2c5h » 2c2w
Atomistry »
  Chlorine »
    PDB 2bwv-2c5h »
      2c2w »

Chlorine in PDB 2c2w: The Fluorinase From Streptomyces Cattleya Is Also A Chlorinase. Structure of 5'-Chloro-5'-Deoxyadenosine Crystallised in the Fluorinase.

Enzymatic activity of The Fluorinase From Streptomyces Cattleya Is Also A Chlorinase. Structure of 5'-Chloro-5'-Deoxyadenosine Crystallised in the Fluorinase.

All present enzymatic activity of The Fluorinase From Streptomyces Cattleya Is Also A Chlorinase. Structure of 5'-Chloro-5'-Deoxyadenosine Crystallised in the Fluorinase.:
2.5.1.63;

Protein crystallography data

The structure of The Fluorinase From Streptomyces Cattleya Is Also A Chlorinase. Structure of 5'-Chloro-5'-Deoxyadenosine Crystallised in the Fluorinase., PDB code: 2c2w was solved by A.R.Mcewan, J.H.Naismith, D.O'hagan, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 45.00 / 2.00
Space group C 2 2 21
Cell size a, b, c (Å), α, β, γ (°) 75.510, 129.206, 183.153, 90.00, 90.00, 90.00
R / Rfree (%) 19.6 / 24.9

Chlorine Binding Sites:

Pages:

>>> Page 1 <<< Page 2, Binding sites: 11 - 13;

Binding sites:

The binding sites of Chlorine atom in the The Fluorinase From Streptomyces Cattleya Is Also A Chlorinase. Structure of 5'-Chloro-5'-Deoxyadenosine Crystallised in the Fluorinase. (pdb code 2c2w). This binding sites where shown within 5.0 Angstroms radius around Chlorine atom.
In total 13 binding sites of Chlorine where determined in the The Fluorinase From Streptomyces Cattleya Is Also A Chlorinase. Structure of 5'-Chloro-5'-Deoxyadenosine Crystallised in the Fluorinase., PDB code: 2c2w:
Jump to Chlorine binding site number: 1; 2; 3; 4; 5; 6; 7; 8; 9; 10;

Chlorine binding site 1 out of 13 in 2c2w

Go back to Chlorine Binding Sites List in 2c2w
Chlorine binding site 1 out of 13 in the The Fluorinase From Streptomyces Cattleya Is Also A Chlorinase. Structure of 5'-Chloro-5'-Deoxyadenosine Crystallised in the Fluorinase.


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 1 of The Fluorinase From Streptomyces Cattleya Is Also A Chlorinase. Structure of 5'-Chloro-5'-Deoxyadenosine Crystallised in the Fluorinase. within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Cl500

b:26.2
occ:0.70
 CL A:5CD500 0.0 26.2 0.7
C5' A:5CD500 1.1 21.0 0.3
C5' A:5CD500 1.8 22.4 0.7
C4' A:5CD500 2.4 20.7 0.3
CL A:5CD500 2.4 23.3 0.3
C4' A:5CD500 2.7 21.5 0.7
O4' A:5CD500 3.0 20.6 0.3
C3' A:5CD500 3.0 20.1 0.3
O4' A:5CD500 3.1 21.4 0.7
C3' A:5CD500 3.1 20.5 0.7
O A:THR155 3.5 28.2 1.0
CD2 A:LEU17 3.6 30.0 1.0
CD1 A:PHE156 3.7 33.3 1.0
O B:HOH2144 3.9 35.2 1.0
CE1 A:PHE156 3.9 32.6 1.0
O3' A:5CD500 4.0 20.0 0.3
C2' A:5CD500 4.1 19.9 0.3
C2' A:5CD500 4.1 20.0 0.7
C1' A:5CD500 4.1 19.9 0.3
O3' A:5CD500 4.1 19.5 0.7
C1' A:5CD500 4.2 19.9 0.7
CE2 B:PHE213 4.3 29.9 1.0
CG A:PHE156 4.3 32.1 1.0
CZ B:PHE213 4.4 29.6 1.0
C8 A:5CD500 4.5 19.7 1.0
CA A:PHE156 4.5 29.3 1.0
C A:THR155 4.6 29.0 1.0
CZ A:PHE156 4.7 31.8 1.0
N9 A:5CD500 4.7 20.2 1.0
CB A:PHE156 4.9 30.6 1.0

Chlorine binding site 2 out of 13 in 2c2w

Go back to Chlorine Binding Sites List in 2c2w
Chlorine binding site 2 out of 13 in the The Fluorinase From Streptomyces Cattleya Is Also A Chlorinase. Structure of 5'-Chloro-5'-Deoxyadenosine Crystallised in the Fluorinase.


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 2 of The Fluorinase From Streptomyces Cattleya Is Also A Chlorinase. Structure of 5'-Chloro-5'-Deoxyadenosine Crystallised in the Fluorinase. within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Cl500

b:23.3
occ:0.30
 CL A:5CD500 0.0 23.3 0.3
C5' A:5CD500 1.5 22.4 0.7
C5' A:5CD500 1.8 21.0 0.3
CD1 A:PHE156 2.3 33.3 1.0
CL A:5CD500 2.4 26.2 0.7
CE1 A:PHE156 2.7 32.6 1.0
C4' A:5CD500 2.7 20.7 0.3
C4' A:5CD500 2.8 21.5 0.7
CB A:SER158 3.2 29.4 1.0
N A:SER158 3.4 29.4 1.0
CA A:PHE156 3.4 29.3 1.0
CG A:PHE156 3.4 32.1 1.0
C3' A:5CD500 3.5 20.5 0.7
C3' A:5CD500 3.5 20.1 0.3
C A:PHE156 3.6 28.9 1.0
OG A:SER158 3.6 28.1 1.0
CD2 A:LEU17 3.7 30.0 1.0
O3' A:5CD500 3.7 20.0 0.3
CA A:SER158 3.8 29.3 1.0
O3' A:5CD500 3.8 19.5 0.7
O A:THR155 3.9 28.2 1.0
O4' A:5CD500 3.9 21.4 0.7
N A:TYR157 3.9 28.8 1.0
O4' A:5CD500 3.9 20.6 0.3
CZ A:PHE156 4.0 31.8 1.0
CB A:PHE156 4.0 30.6 1.0
O A:PHE156 4.0 28.2 1.0
N A:ARG159 4.1 29.2 1.0
C A:SER158 4.4 29.5 1.0
CD2 A:PHE156 4.5 34.1 1.0
C A:TYR157 4.5 29.3 1.0
N A:PHE156 4.5 29.3 1.0
C A:THR155 4.6 29.0 1.0
CE2 A:PHE156 4.7 33.9 1.0
CA A:TYR157 4.8 29.0 1.0
CG A:LEU17 4.9 29.8 1.0
C2' A:5CD500 4.9 20.0 0.7
C2' A:5CD500 4.9 19.9 0.3

Chlorine binding site 3 out of 13 in 2c2w

Go back to Chlorine Binding Sites List in 2c2w
Chlorine binding site 3 out of 13 in the The Fluorinase From Streptomyces Cattleya Is Also A Chlorinase. Structure of 5'-Chloro-5'-Deoxyadenosine Crystallised in the Fluorinase.


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 3 of The Fluorinase From Streptomyces Cattleya Is Also A Chlorinase. Structure of 5'-Chloro-5'-Deoxyadenosine Crystallised in the Fluorinase. within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Cl1299

b:53.5
occ:1.00
 CD2 A:HIS287 3.4 32.6 1.0
NZ A:LYS289 3.8 41.7 1.0
NE2 A:HIS287 4.2 34.4 1.0
CG A:HIS287 4.4 31.9 1.0
CE A:LYS289 4.5 41.9 1.0
CB A:HIS287 4.9 31.1 1.0

Chlorine binding site 4 out of 13 in 2c2w

Go back to Chlorine Binding Sites List in 2c2w
Chlorine binding site 4 out of 13 in the The Fluorinase From Streptomyces Cattleya Is Also A Chlorinase. Structure of 5'-Chloro-5'-Deoxyadenosine Crystallised in the Fluorinase.


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 4 of The Fluorinase From Streptomyces Cattleya Is Also A Chlorinase. Structure of 5'-Chloro-5'-Deoxyadenosine Crystallised in the Fluorinase. within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Cl1300

b:46.3
occ:1.00
 OG1 C:THR155 2.6 30.2 1.0
O A:HOH2156 2.7 20.6 1.0
N A:SER269 2.9 31.8 1.0
CB A:ASN268 3.4 29.5 1.0
CA A:ASN268 3.5 29.3 1.0
OG A:SER269 3.5 35.0 1.0
CB C:THR155 3.5 30.2 1.0
C A:ASN268 3.6 30.6 1.0
CB A:SER269 3.7 34.0 1.0
CA A:SER269 3.9 33.9 1.0
O A:HOH2130 3.9 29.5 1.0
O A:HOH2160 4.2 35.6 1.0
O C:THR155 4.3 29.2 1.0
CG2 C:THR155 4.3 28.4 1.0
CE1 A:TYR266 4.4 25.6 1.0
CZ2 A:TRP217 4.4 29.4 1.0
NH2 A:ARG270 4.4 45.0 1.0
CG A:ASN268 4.5 29.8 1.0
C C:THR155 4.7 29.9 1.0
NE1 A:TRP217 4.7 28.4 1.0
CA C:THR155 4.7 30.0 1.0
NE A:ARG270 4.8 45.7 1.0
O A:ASN268 4.8 29.9 1.0
CE2 A:TRP217 4.8 29.2 1.0
O C:HOH2109 4.8 20.1 1.0
N A:ASN268 4.9 28.6 1.0
CZ A:PHE254 4.9 26.9 1.0

Chlorine binding site 5 out of 13 in 2c2w

Go back to Chlorine Binding Sites List in 2c2w
Chlorine binding site 5 out of 13 in the The Fluorinase From Streptomyces Cattleya Is Also A Chlorinase. Structure of 5'-Chloro-5'-Deoxyadenosine Crystallised in the Fluorinase.


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 5 of The Fluorinase From Streptomyces Cattleya Is Also A Chlorinase. Structure of 5'-Chloro-5'-Deoxyadenosine Crystallised in the Fluorinase. within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Cl1301

b:43.9
occ:1.00
 CG A:PHE110 3.4 31.2 1.0
CB A:PHE110 3.6 31.6 1.0
NH1 A:ARG112 3.7 28.6 1.0
O C:HOH2026 3.7 32.6 1.0
CD2 A:PHE110 3.8 32.3 1.0
CD1 A:PHE110 3.8 32.4 1.0
O C:SER33 3.9 29.6 1.0
CB C:SER33 4.2 29.4 1.0
O A:HOH2069 4.3 27.7 1.0
CE2 A:PHE110 4.4 31.1 1.0
CE1 A:PHE110 4.5 31.0 1.0
C C:SER33 4.5 30.1 1.0
CZ A:ARG112 4.5 30.2 1.0
NH2 A:ARG112 4.7 30.8 1.0
CZ A:PHE110 4.7 31.7 1.0
CA C:SER33 4.7 29.8 1.0
CA A:PHE110 4.8 30.9 1.0
OG C:SER33 4.9 30.2 1.0
O A:HOH2042 5.0 23.1 1.0

Chlorine binding site 6 out of 13 in 2c2w

Go back to Chlorine Binding Sites List in 2c2w
Chlorine binding site 6 out of 13 in the The Fluorinase From Streptomyces Cattleya Is Also A Chlorinase. Structure of 5'-Chloro-5'-Deoxyadenosine Crystallised in the Fluorinase.


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 6 of The Fluorinase From Streptomyces Cattleya Is Also A Chlorinase. Structure of 5'-Chloro-5'-Deoxyadenosine Crystallised in the Fluorinase. within 5.0Å range:
probe atom residue distance (Å) B Occ
B:Cl500

b:32.0
occ:0.70
 CL B:5CD500 0.0 32.0 0.7
C5' B:5CD500 1.2 24.9 0.3
C5' B:5CD500 1.8 28.1 0.7
CL B:5CD500 2.2 25.6 0.3
C4' B:5CD500 2.4 25.1 0.3
C4' B:5CD500 2.7 26.7 0.7
C3' B:5CD500 2.8 24.5 0.3
O4' B:5CD500 3.0 26.9 0.7
O4' B:5CD500 3.1 25.2 0.3
C3' B:5CD500 3.1 25.4 0.7
O B:THR155 3.5 31.7 1.0
CD2 B:LEU17 3.5 28.6 1.0
CD1 B:PHE156 3.7 35.8 1.0
C2' B:5CD500 3.8 24.5 0.3
CE1 B:PHE156 3.9 37.8 1.0
O3' B:5CD500 4.0 24.1 0.3
C1' B:5CD500 4.1 24.9 0.3
C2' B:5CD500 4.1 24.5 0.7
O3' B:5CD500 4.1 24.0 0.7
C1' B:5CD500 4.1 25.1 0.7
CE2 C:PHE213 4.3 29.1 1.0
CG B:PHE156 4.3 34.1 1.0
CA B:PHE156 4.4 31.2 1.0
CZ C:PHE213 4.4 29.9 1.0
C B:THR155 4.6 30.6 1.0
C8 B:5CD500 4.6 25.0 1.0
CZ B:PHE156 4.7 34.6 1.0
N9 B:5CD500 4.8 25.4 1.0
CB B:PHE156 4.8 31.6 1.0

Chlorine binding site 7 out of 13 in 2c2w

Go back to Chlorine Binding Sites List in 2c2w
Chlorine binding site 7 out of 13 in the The Fluorinase From Streptomyces Cattleya Is Also A Chlorinase. Structure of 5'-Chloro-5'-Deoxyadenosine Crystallised in the Fluorinase.


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 7 of The Fluorinase From Streptomyces Cattleya Is Also A Chlorinase. Structure of 5'-Chloro-5'-Deoxyadenosine Crystallised in the Fluorinase. within 5.0Å range:
probe atom residue distance (Å) B Occ
B:Cl500

b:25.6
occ:0.30
 CL B:5CD500 0.0 25.6 0.3
C5' B:5CD500 1.5 28.1 0.7
C5' B:5CD500 1.8 24.9 0.3
CL B:5CD500 2.2 32.0 0.7
CD1 B:PHE156 2.3 35.8 1.0
CE1 B:PHE156 2.8 37.8 1.0
C4' B:5CD500 2.8 25.1 0.3
C4' B:5CD500 3.0 26.7 0.7
CA B:PHE156 3.3 31.2 1.0
CG B:PHE156 3.3 34.1 1.0
CB B:SER158 3.4 28.6 1.0
C3' B:5CD500 3.4 24.5 0.3
N B:SER158 3.5 28.4 1.0
C B:PHE156 3.5 30.6 1.0
CD2 B:LEU17 3.6 28.6 1.0
C3' B:5CD500 3.7 25.4 0.7
O3' B:5CD500 3.8 24.1 0.3
O B:THR155 3.8 31.7 1.0
CB B:PHE156 3.9 31.6 1.0
OG B:SER158 3.9 28.4 1.0
O4' B:5CD500 3.9 26.9 0.7
N B:TYR157 3.9 29.7 1.0
CA B:SER158 3.9 28.4 1.0
O B:PHE156 4.0 30.1 1.0
CZ B:PHE156 4.0 34.6 1.0
O4' B:5CD500 4.0 25.2 0.3
O3' B:5CD500 4.1 24.0 0.7
N B:ARG159 4.2 28.8 1.0
N B:PHE156 4.4 31.1 1.0
CD2 B:PHE156 4.4 35.2 1.0
C B:THR155 4.5 30.6 1.0
C B:SER158 4.6 28.4 1.0
C B:TYR157 4.6 28.5 1.0
CE2 B:PHE156 4.7 36.7 1.0
C2' B:5CD500 4.8 24.5 0.3
CA B:TYR157 4.9 29.2 1.0
CG B:LEU17 4.9 29.5 1.0

Chlorine binding site 8 out of 13 in 2c2w

Go back to Chlorine Binding Sites List in 2c2w
Chlorine binding site 8 out of 13 in the The Fluorinase From Streptomyces Cattleya Is Also A Chlorinase. Structure of 5'-Chloro-5'-Deoxyadenosine Crystallised in the Fluorinase.


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 8 of The Fluorinase From Streptomyces Cattleya Is Also A Chlorinase. Structure of 5'-Chloro-5'-Deoxyadenosine Crystallised in the Fluorinase. within 5.0Å range:
probe atom residue distance (Å) B Occ
B:Cl1299

b:37.7
occ:1.00
 O B:HOH2144 2.8 35.2 1.0
OH B:TYR266 2.9 28.7 1.0
O B:HOH2177 2.9 27.0 1.0
NE1 B:TRP217 3.0 29.6 1.0
OD2 B:ASP210 3.2 32.8 1.0
ND2 B:ASN215 3.5 25.1 1.0
CE1 B:TYR266 3.6 28.8 1.0
CZ B:TYR266 3.7 29.6 1.0
CE2 B:TRP217 3.8 29.1 1.0
CZ B:PHE254 3.9 26.4 1.0
CB B:ASN268 3.9 32.0 1.0
CZ2 B:TRP217 4.0 30.7 1.0
CD1 B:TRP217 4.1 28.9 1.0
CG B:ASP210 4.1 31.9 1.0
CB B:ASN215 4.2 27.8 1.0
CG B:ASN215 4.2 28.0 1.0
CE1 B:PHE254 4.3 26.8 1.0
CB B:ASP210 4.7 30.9 1.0
CA B:ASN268 4.7 31.6 1.0
CD1 B:TYR266 4.9 28.3 1.0
OG1 A:THR155 5.0 31.7 1.0
CE2 B:TYR266 5.0 28.4 1.0

Chlorine binding site 9 out of 13 in 2c2w

Go back to Chlorine Binding Sites List in 2c2w
Chlorine binding site 9 out of 13 in the The Fluorinase From Streptomyces Cattleya Is Also A Chlorinase. Structure of 5'-Chloro-5'-Deoxyadenosine Crystallised in the Fluorinase.


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 9 of The Fluorinase From Streptomyces Cattleya Is Also A Chlorinase. Structure of 5'-Chloro-5'-Deoxyadenosine Crystallised in the Fluorinase. within 5.0Å range:
probe atom residue distance (Å) B Occ
B:Cl1300

b:59.1
occ:1.00
 ND1 B:HIS287 3.5 34.6 1.0
CE1 B:HIS287 4.2 35.1 1.0
CE B:LYS289 4.2 41.2 1.0
NZ B:LYS289 4.4 41.6 1.0
CG B:HIS287 4.6 33.9 1.0
O B:HOH2189 4.7 38.5 1.0
CB B:HIS287 4.8 32.6 1.0

Chlorine binding site 10 out of 13 in 2c2w

Go back to Chlorine Binding Sites List in 2c2w
Chlorine binding site 10 out of 13 in the The Fluorinase From Streptomyces Cattleya Is Also A Chlorinase. Structure of 5'-Chloro-5'-Deoxyadenosine Crystallised in the Fluorinase.


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 10 of The Fluorinase From Streptomyces Cattleya Is Also A Chlorinase. Structure of 5'-Chloro-5'-Deoxyadenosine Crystallised in the Fluorinase. within 5.0Å range:
probe atom residue distance (Å) B Occ
C:Cl500

b:26.6
occ:0.70
 CL C:5CD500 0.0 26.6 0.7
C5' C:5CD500 0.7 22.6 0.3
C5' C:5CD500 1.8 23.1 0.7
CL C:5CD500 2.0 23.9 0.3
C4' C:5CD500 2.1 22.1 0.3
C4' C:5CD500 2.7 22.7 0.7
O4' C:5CD500 2.8 22.0 0.3
C3' C:5CD500 2.9 21.3 0.3
O4' C:5CD500 3.0 22.9 0.7
C3' C:5CD500 3.0 21.4 0.7
O C:THR155 3.3 29.2 1.0
O A:HOH2160 3.4 35.6 1.0
CD2 C:LEU17 3.5 28.1 1.0
CD1 C:PHE156 3.5 33.1 1.0
CE1 C:PHE156 3.7 33.0 1.0
O3' C:5CD500 3.9 22.2 0.3
C2' C:5CD500 4.0 21.3 0.3
C1' C:5CD500 4.0 20.9 0.2
O3' C:5CD500 4.0 23.0 0.7
C2' C:5CD500 4.1 21.4 0.7
C1' C:5CD500 4.1 20.7 0.7
CA C:PHE156 4.2 30.0 1.0
O A:HOH2130 4.2 29.5 1.0
CG C:PHE156 4.2 31.0 1.0
C C:THR155 4.4 29.9 1.0
CZ C:PHE156 4.7 32.5 1.0
CE2 A:PHE213 4.7 30.2 1.0
C8 C:5CD500 4.7 20.3 1.0
CB C:PHE156 4.7 30.8 1.0
CB C:SER158 4.7 28.9 1.0
CZ A:PHE213 4.8 29.5 1.0
N9 C:5CD500 4.8 21.9 1.0
OG C:SER158 4.8 30.6 1.0
N C:PHE156 4.9 29.8 1.0
C C:PHE156 4.9 30.0 1.0
CG C:LEU17 5.0 28.7 1.0

Reference:

H.Deng, S.L.Cobb, A.R.Mcewan, R.P.Mcglinchey, J.H.Naismith, D.O'hagan, D.A.Robinson, J.B.Spencer. The Fluorinase From Streptomyces Cattleya Is Also A Chlorinase. Angew. Chem. Int. Ed. Engl. V. 45 759 2006.
ISSN: ISSN 1433-7851
PubMed: 16370017
DOI: 10.1002/ANIE.200503582
Page generated: Sat Jul 20 06:04:54 2024

Last articles

Zn in 9JPJ
Zn in 9JP7
Zn in 9JPK
Zn in 9JPL
Zn in 9GN6
Zn in 9GN7
Zn in 9GKU
Zn in 9GKW
Zn in 9GKX
Zn in 9GL0
© Copyright 2008-2020 by atomistry.com
Home   |    Site Map   |    Copyright   |    Contact us   |    Privacy