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Bromine in PDB 6zxx: Catabolic Reductive Dehalogenase Nprdha, N-Terminally Tagged.

Protein crystallography data

The structure of Catabolic Reductive Dehalogenase Nprdha, N-Terminally Tagged., PDB code: 6zxx was solved by D.Leys, T.Halliwell, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 106.58 / 1.99
Space group C 1 2 1
Cell size a, b, c (Å), α, β, γ (°) 180.182, 170.391, 107.957, 90.00, 99.16, 90.00
R / Rfree (%) 18.2 / 21.8

Other elements in 6zxx:

The structure of Catabolic Reductive Dehalogenase Nprdha, N-Terminally Tagged. also contains other interesting chemical elements:

Cobalt (Co) 3 atoms
Iron (Fe) 24 atoms
Sodium (Na) 3 atoms

Bromine Binding Sites:

Pages:

>>> Page 1 <<< Page 2, Binding sites: 11 - 12;

Binding sites:

The binding sites of Bromine atom in the Catabolic Reductive Dehalogenase Nprdha, N-Terminally Tagged. (pdb code 6zxx). This binding sites where shown within 5.0 Angstroms radius around Bromine atom.
In total 12 binding sites of Bromine where determined in the Catabolic Reductive Dehalogenase Nprdha, N-Terminally Tagged., PDB code: 6zxx:
Jump to Bromine binding site number: 1; 2; 3; 4; 5; 6; 7; 8; 9; 10;

Bromine binding site 1 out of 12 in 6zxx

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Bromine binding site 1 out of 12 in the Catabolic Reductive Dehalogenase Nprdha, N-Terminally Tagged.


Mono view


Stereo pair view

A full contact list of Bromine with other atoms in the Br binding site number 1 of Catabolic Reductive Dehalogenase Nprdha, N-Terminally Tagged. within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Br705

b:20.4
occ:0.40
BR1 A:QSH705 0.0 20.4 0.4
BR1 A:QSB706 0.9 21.2 0.3
C02 A:QSB706 1.2 20.6 0.3
C02 A:QSH705 1.9 20.5 0.4
C03 A:QSB706 2.2 20.4 0.3
C01 A:QSB706 2.3 20.4 0.3
O10 A:QSB706 2.6 20.0 0.3
C01 A:QSH705 2.8 20.8 0.4
C03 A:QSH705 2.9 20.7 0.4
O09 A:QSH705 3.1 20.3 0.4
CB A:SER422 3.4 18.2 1.0
OG A:SER422 3.4 20.0 1.0
C04 A:QSB706 3.5 20.3 0.3
C06 A:QSB706 3.6 21.0 0.3
CE A:MET423 3.7 26.9 1.0
O A:HOH970 3.8 10.0 1.0
NH1 A:ARG552 3.8 19.4 1.0
CB A:PRO311 3.9 22.1 1.0
CA A:ALA419 3.9 14.7 1.0
CB A:ALA419 3.9 15.9 1.0
C05 A:QSB706 4.0 20.4 0.3
C06 A:QSH705 4.1 21.1 0.4
C04 A:QSH705 4.1 20.6 0.4
CB A:ALA560 4.2 19.0 1.0
O A:ALA419 4.4 15.0 1.0
CE2 A:PHE310 4.4 20.6 1.0
C05 A:QSH705 4.7 20.9 0.4
C A:ALA419 4.7 14.9 1.0
CA A:PRO311 4.8 21.4 1.0
C07 A:QSB706 4.8 22.1 0.3
CZ A:ARG552 4.8 17.7 1.0
CA A:SER422 4.8 17.6 1.0
N A:ALA419 4.9 15.6 1.0
CG A:PRO311 4.9 22.5 1.0
O09 A:QSB706 4.9 22.3 0.3
CG A:MET423 5.0 19.5 1.0

Bromine binding site 2 out of 12 in 6zxx

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Bromine binding site 2 out of 12 in the Catabolic Reductive Dehalogenase Nprdha, N-Terminally Tagged.


Mono view


Stereo pair view

A full contact list of Bromine with other atoms in the Br binding site number 2 of Catabolic Reductive Dehalogenase Nprdha, N-Terminally Tagged. within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Br705

b:23.1
occ:0.40
BR2 A:QSH705 0.0 23.1 0.4
BR A:BR707 0.8 21.1 0.3
C04 A:QSH705 1.9 20.6 0.4
C04 A:QSB706 2.4 20.3 0.3
C03 A:QSH705 2.8 20.7 0.4
C05 A:QSH705 2.9 20.9 0.4
O09 A:QSH705 2.9 20.3 0.4
C05 A:QSB706 3.0 20.4 0.3
CO A:B12703 3.2 15.7 1.0
OH A:TYR426 3.2 21.2 1.0
N24 A:B12703 3.3 16.3 1.0
NZ A:LYS488 3.4 19.0 1.0
C03 A:QSB706 3.5 20.4 0.3
NH2 A:ARG552 3.6 17.8 1.0
N23 A:B12703 3.7 15.2 1.0
CE2 A:PHE291 3.7 22.2 1.0
N21 A:B12703 3.7 16.0 1.0
O10 A:QSB706 3.7 20.0 0.3
N22 A:B12703 4.1 15.6 1.0
C02 A:QSH705 4.1 20.5 0.4
C19 A:B12703 4.1 16.4 1.0
O A:HOH826 4.2 10.1 0.5
C06 A:QSH705 4.2 21.1 0.4
C16 A:B12703 4.2 16.3 1.0
C14 A:B12703 4.3 15.6 1.0
C11 A:B12703 4.3 15.9 1.0
C6 A:B12703 4.3 15.0 1.0
C06 A:QSB706 4.3 21.0 0.3
C4 A:B12703 4.4 16.6 1.0
CZ A:PHE291 4.4 25.8 1.0
CZ A:TYR426 4.4 19.1 1.0
C54 A:B12703 4.4 15.8 1.0
C15 A:B12703 4.5 15.3 1.0
C9 A:B12703 4.5 14.1 1.0
C1 A:B12703 4.5 15.7 1.0
C10 A:B12703 4.6 15.2 1.0
C5 A:B12703 4.6 15.9 1.0
C37 A:B12703 4.6 14.3 1.0
C01 A:QSH705 4.6 20.8 0.4
CZ A:ARG552 4.7 17.7 1.0
C02 A:QSB706 4.7 20.6 0.3
C26 A:B12703 4.7 16.4 1.0
CD2 A:PHE291 4.7 23.1 1.0
ND2 A:ASN452 4.7 13.9 0.5
CE2 A:TYR426 4.7 18.6 1.0
CE A:LYS488 4.8 18.4 1.0
NH1 A:ARG552 4.8 19.4 1.0
C17 A:B12703 4.9 16.4 1.0
O A:HOH801 4.9 24.3 0.5
C01 A:QSB706 5.0 20.4 0.3

Bromine binding site 3 out of 12 in 6zxx

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Bromine binding site 3 out of 12 in the Catabolic Reductive Dehalogenase Nprdha, N-Terminally Tagged.


Mono view


Stereo pair view

A full contact list of Bromine with other atoms in the Br binding site number 3 of Catabolic Reductive Dehalogenase Nprdha, N-Terminally Tagged. within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Br706

b:21.2
occ:0.30
BR1 A:QSB706 0.0 21.2 0.3
BR1 A:QSH705 0.9 20.4 0.4
C02 A:QSB706 1.9 20.6 0.3
C02 A:QSH705 2.6 20.5 0.4
C01 A:QSB706 2.9 20.4 0.3
C03 A:QSB706 2.9 20.4 0.3
O10 A:QSB706 3.1 20.0 0.3
CB A:ALA419 3.3 15.9 1.0
CA A:ALA419 3.4 14.7 1.0
CB A:ALA560 3.4 19.0 1.0
O A:HOH970 3.4 10.0 1.0
C01 A:QSH705 3.4 20.8 0.4
C03 A:QSH705 3.6 20.7 0.4
CB A:PRO311 3.7 22.1 1.0
O09 A:QSH705 3.7 20.3 0.4
OG A:SER422 3.7 20.0 1.0
NH1 A:ARG552 3.7 19.4 1.0
CB A:SER422 3.8 18.2 1.0
CE2 A:PHE310 4.1 20.6 1.0
C06 A:QSB706 4.2 21.0 0.3
C04 A:QSB706 4.2 20.3 0.3
CE A:MET423 4.3 26.9 1.0
O A:ALA419 4.3 15.0 1.0
N A:ALA419 4.3 15.6 1.0
CA A:PRO311 4.3 21.4 1.0
C A:ALA419 4.4 14.9 1.0
CD2 A:PHE310 4.7 21.3 1.0
C05 A:QSB706 4.7 20.4 0.3
C06 A:QSH705 4.8 21.1 0.4
CZ A:ARG552 4.8 17.7 1.0
CG A:PRO311 4.8 22.5 1.0
C04 A:QSH705 4.8 20.6 0.4
CA A:ALA560 4.9 17.9 1.0
CZ A:PHE310 4.9 20.2 1.0
O A:SER559 4.9 17.3 1.0
O A:SER418 5.0 16.1 1.0
C A:SER418 5.0 16.4 1.0

Bromine binding site 4 out of 12 in 6zxx

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Bromine binding site 4 out of 12 in the Catabolic Reductive Dehalogenase Nprdha, N-Terminally Tagged.


Mono view


Stereo pair view

A full contact list of Bromine with other atoms in the Br binding site number 4 of Catabolic Reductive Dehalogenase Nprdha, N-Terminally Tagged. within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Br707

b:21.1
occ:0.30
BR2 A:QSH705 0.8 23.1 0.4
CO A:B12703 2.4 15.7 1.0
C04 A:QSH705 2.7 20.6 0.4
N24 A:B12703 2.9 16.3 1.0
N21 A:B12703 3.1 16.0 1.0
N23 A:B12703 3.1 15.2 1.0
C04 A:QSB706 3.1 20.3 0.3
N22 A:B12703 3.3 15.6 1.0
O09 A:QSH705 3.3 20.3 0.4
NZ A:LYS488 3.4 19.0 1.0
C03 A:QSH705 3.4 20.7 0.4
NH2 A:ARG552 3.6 17.8 1.0
C6 A:B12703 3.6 15.0 1.0
OH A:TYR426 3.6 21.2 1.0
C05 A:QSH705 3.7 20.9 0.4
C4 A:B12703 3.7 16.6 1.0
C11 A:B12703 3.7 15.9 1.0
C9 A:B12703 3.8 14.1 1.0
C19 A:B12703 3.8 16.4 1.0
C05 A:QSB706 3.9 20.4 0.3
C14 A:B12703 3.9 15.6 1.0
C5 A:B12703 3.9 15.9 1.0
C10 A:B12703 3.9 15.2 1.0
C16 A:B12703 4.0 16.3 1.0
C1 A:B12703 4.0 15.7 1.0
C03 A:QSB706 4.0 20.4 0.3
O10 A:QSB706 4.1 20.0 0.3
CE2 A:PHE291 4.1 22.2 1.0
C37 A:B12703 4.1 14.3 1.0
C15 A:B12703 4.3 15.3 1.0
C7 A:B12703 4.4 13.4 1.0
C26 A:B12703 4.5 16.4 1.0
O A:HOH826 4.5 10.1 0.5
CZ A:ARG552 4.6 17.7 1.0
C54 A:B12703 4.6 15.8 1.0
CZ A:PHE291 4.7 25.8 1.0
C02 A:QSH705 4.7 20.5 0.4
C38 A:B12703 4.8 15.1 1.0
O39 A:B12703 4.8 17.9 1.0
C2 A:B12703 4.8 16.3 1.0
C8 A:B12703 4.8 12.8 1.0
CE A:LYS488 4.8 18.4 1.0
NH1 A:ARG552 4.8 19.4 1.0
CZ A:TYR426 4.8 19.1 1.0
C17 A:B12703 4.9 16.4 1.0
C3 A:B12703 4.9 16.3 1.0
C06 A:QSH705 5.0 21.1 0.4
C12 A:B12703 5.0 14.9 1.0
C18 A:B12703 5.0 17.3 1.0

Bromine binding site 5 out of 12 in 6zxx

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Bromine binding site 5 out of 12 in the Catabolic Reductive Dehalogenase Nprdha, N-Terminally Tagged.


Mono view


Stereo pair view

A full contact list of Bromine with other atoms in the Br binding site number 5 of Catabolic Reductive Dehalogenase Nprdha, N-Terminally Tagged. within 5.0Å range:
probe atom residue distance (Å) B Occ
B:Br705

b:24.6
occ:0.40
BR1 B:QSH705 0.0 24.6 0.4
BR1 B:QSB706 0.9 29.2 0.3
C02 B:QSB706 1.2 26.1 0.3
C02 B:QSH705 1.9 22.5 0.4
C03 B:QSB706 2.2 25.6 0.3
C01 B:QSB706 2.3 25.7 0.3
O10 B:QSB706 2.6 23.8 0.3
C03 B:QSH705 2.8 22.9 0.4
C01 B:QSH705 2.8 22.8 0.4
O09 B:QSH705 2.9 20.0 0.4
C04 B:QSB706 3.4 25.4 0.3
CB B:SER422 3.5 18.2 1.0
C06 B:QSB706 3.5 25.9 0.3
OG B:SER422 3.6 16.4 1.0
O B:HOH991 3.6 15.9 1.0
CE B:MET423 3.7 29.3 1.0
CB B:PRO311 3.9 25.7 1.0
CB B:ALA419 4.0 21.6 1.0
CA B:ALA419 4.0 21.0 1.0
C05 B:QSB706 4.0 25.5 0.3
C06 B:QSH705 4.1 22.9 0.4
C04 B:QSH705 4.1 22.3 0.4
CB B:ALA560 4.1 24.5 1.0
NH2 B:ARG552 4.2 26.9 1.0
CE1 B:PHE310 4.3 25.6 1.0
O B:ALA419 4.4 19.2 1.0
NH1 B:ARG552 4.6 25.9 1.0
C05 B:QSH705 4.6 22.6 0.4
C B:ALA419 4.7 20.5 1.0
CA B:PRO311 4.7 25.2 1.0
C07 B:QSB706 4.8 26.3 0.3
CZ B:ARG552 4.9 25.6 1.0
CG B:PRO311 4.9 24.2 1.0
CZ B:PHE310 4.9 24.2 1.0
CA B:SER422 4.9 18.9 1.0
N B:ALA419 5.0 23.8 1.0

Bromine binding site 6 out of 12 in 6zxx

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Bromine binding site 6 out of 12 in the Catabolic Reductive Dehalogenase Nprdha, N-Terminally Tagged.


Mono view


Stereo pair view

A full contact list of Bromine with other atoms in the Br binding site number 6 of Catabolic Reductive Dehalogenase Nprdha, N-Terminally Tagged. within 5.0Å range:
probe atom residue distance (Å) B Occ
B:Br705

b:24.5
occ:0.40
BR2 B:QSH705 0.0 24.5 0.4
BR B:BR707 0.9 23.2 0.3
C04 B:QSH705 1.9 22.3 0.4
C04 B:QSB706 2.4 25.4 0.3
C05 B:QSH705 2.8 22.6 0.4
C03 B:QSH705 2.8 22.9 0.4
C05 B:QSB706 3.0 25.5 0.3
OH B:TYR426 3.1 26.9 0.5
OH B:TYR426 3.1 27.4 0.5
N24 B:B12703 3.1 19.1 1.0
O09 B:QSH705 3.1 20.0 0.4
CO B:B12703 3.2 20.4 1.0
NH1 B:ARG552 3.2 25.9 1.0
NZ B:LYS488 3.3 17.3 1.0
C03 B:QSB706 3.5 25.6 0.3
N21 B:B12703 3.7 20.1 1.0
N23 B:B12703 3.7 19.3 1.0
CE2 B:PHE291 3.8 20.6 1.0
O10 B:QSB706 3.8 23.8 0.3
C19 B:B12703 4.0 18.2 1.0
C16 B:B12703 4.1 18.5 1.0
C06 B:QSH705 4.1 22.9 0.4
C02 B:QSH705 4.1 22.5 0.4
N22 B:B12703 4.2 19.6 1.0
C06 B:QSB706 4.3 25.9 0.3
C14 B:B12703 4.3 18.4 1.0
CZ B:TYR426 4.3 24.9 0.5
CZ B:TYR426 4.3 25.3 0.5
C54 B:B12703 4.4 17.4 1.0
O B:HOH855 4.4 29.4 1.0
C4 B:B12703 4.4 19.5 1.0
C6 B:B12703 4.4 20.1 1.0
C15 B:B12703 4.4 18.1 1.0
C1 B:B12703 4.4 18.9 1.0
CZ B:PHE291 4.5 20.6 1.0
CZ B:ARG552 4.5 25.6 1.0
C11 B:B12703 4.5 18.7 1.0
C37 B:B12703 4.5 21.3 1.0
C26 B:B12703 4.6 17.8 1.0
ND2 B:ASN452 4.6 19.4 0.5
C02 B:QSB706 4.6 26.1 0.3
C01 B:QSH705 4.6 22.8 0.4
C9 B:B12703 4.6 19.1 1.0
C5 B:B12703 4.7 19.6 1.0
CE2 B:TYR426 4.7 24.2 0.5
CE2 B:TYR426 4.7 24.5 0.5
CD2 B:PHE291 4.7 22.3 1.0
CE B:LYS488 4.7 17.1 1.0
C10 B:B12703 4.8 19.6 1.0
C17 B:B12703 4.8 18.1 1.0
C01 B:QSB706 4.9 25.7 0.3

Bromine binding site 7 out of 12 in 6zxx

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Bromine binding site 7 out of 12 in the Catabolic Reductive Dehalogenase Nprdha, N-Terminally Tagged.


Mono view


Stereo pair view

A full contact list of Bromine with other atoms in the Br binding site number 7 of Catabolic Reductive Dehalogenase Nprdha, N-Terminally Tagged. within 5.0Å range:
probe atom residue distance (Å) B Occ
B:Br706

b:29.2
occ:0.30
BR1 B:QSB706 0.0 29.2 0.3
BR1 B:QSH705 0.9 24.6 0.4
C02 B:QSB706 1.9 26.1 0.3
C02 B:QSH705 2.6 22.5 0.4
C01 B:QSB706 2.9 25.7 0.3
C03 B:QSB706 2.9 25.6 0.3
O10 B:QSB706 3.1 23.8 0.3
O B:HOH991 3.2 15.9 1.0
CB B:ALA560 3.3 24.5 1.0
CB B:ALA419 3.4 21.6 1.0
O09 B:QSH705 3.4 20.0 0.4
C03 B:QSH705 3.5 22.9 0.4
C01 B:QSH705 3.5 22.8 0.4
CA B:ALA419 3.5 21.0 1.0
CB B:PRO311 3.7 25.7 1.0
OG B:SER422 3.8 16.4 1.0
CB B:SER422 3.9 18.2 1.0
CE1 B:PHE310 4.0 25.6 1.0
NH2 B:ARG552 4.0 26.9 1.0
C06 B:QSB706 4.2 25.9 0.3
C04 B:QSB706 4.2 25.4 0.3
CA B:PRO311 4.4 25.2 1.0
CE B:MET423 4.4 29.3 1.0
N B:ALA419 4.4 23.8 1.0
O B:ALA419 4.4 19.2 1.0
C B:ALA419 4.5 20.5 1.0
CD1 B:PHE310 4.6 27.2 1.0
C05 B:QSB706 4.7 25.5 0.3
C06 B:QSH705 4.8 22.9 0.4
C04 B:QSH705 4.8 22.3 0.4
CZ B:ARG552 4.8 25.6 1.0
NH1 B:ARG552 4.8 25.9 1.0
CA B:ALA560 4.8 23.6 1.0
CZ B:PHE310 4.8 24.2 1.0
CG B:PRO311 4.9 24.2 1.0
O B:SER559 4.9 23.8 1.0

Bromine binding site 8 out of 12 in 6zxx

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Bromine binding site 8 out of 12 in the Catabolic Reductive Dehalogenase Nprdha, N-Terminally Tagged.


Mono view


Stereo pair view

A full contact list of Bromine with other atoms in the Br binding site number 8 of Catabolic Reductive Dehalogenase Nprdha, N-Terminally Tagged. within 5.0Å range:
probe atom residue distance (Å) B Occ
B:Br707

b:23.2
occ:0.30
BR2 B:QSH705 0.9 24.5 0.4
CO B:B12703 2.3 20.4 1.0
C04 B:QSH705 2.7 22.3 0.4
N24 B:B12703 2.8 19.1 1.0
N21 B:B12703 2.9 20.1 1.0
N23 B:B12703 3.1 19.3 1.0
NH1 B:ARG552 3.2 25.9 1.0
C04 B:QSB706 3.2 25.4 0.3
N22 B:B12703 3.3 19.6 1.0
NZ B:LYS488 3.3 17.3 1.0
O09 B:QSH705 3.5 20.0 0.4
C03 B:QSH705 3.5 22.9 0.4
C6 B:B12703 3.5 20.1 1.0
OH B:TYR426 3.6 26.9 0.5
OH B:TYR426 3.6 27.4 0.5
C19 B:B12703 3.6 18.2 1.0
C4 B:B12703 3.6 19.5 1.0
C05 B:QSH705 3.7 22.6 0.4
C9 B:B12703 3.8 19.1 1.0
C16 B:B12703 3.8 18.5 1.0
C11 B:B12703 3.9 18.7 1.0
C5 B:B12703 3.9 19.6 1.0
C1 B:B12703 3.9 18.9 1.0
C14 B:B12703 3.9 18.4 1.0
C05 B:QSB706 3.9 25.5 0.3
C37 B:B12703 4.0 21.3 1.0
C03 B:QSB706 4.1 25.6 0.3
C10 B:B12703 4.1 19.6 1.0
CE2 B:PHE291 4.1 20.6 1.0
O10 B:QSB706 4.1 23.8 0.3
C15 B:B12703 4.2 18.1 1.0
CZ B:ARG552 4.3 25.6 1.0
C7 B:B12703 4.4 19.6 1.0
C26 B:B12703 4.4 17.8 1.0
C54 B:B12703 4.6 17.4 1.0
C2 B:B12703 4.7 18.6 1.0
C38 B:B12703 4.7 22.6 1.0
C17 B:B12703 4.8 18.1 1.0
CZ B:PHE291 4.8 20.6 1.0
O B:HOH855 4.8 29.4 1.0
CE B:LYS488 4.8 17.1 1.0
C3 B:B12703 4.8 19.6 1.0
O39 B:B12703 4.8 23.0 1.0
C8 B:B12703 4.8 19.0 1.0
C02 B:QSH705 4.8 22.5 0.4
C18 B:B12703 4.8 18.6 1.0
CZ B:TYR426 4.9 24.9 0.5
CZ B:TYR426 4.9 25.3 0.5

Bromine binding site 9 out of 12 in 6zxx

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Bromine binding site 9 out of 12 in the Catabolic Reductive Dehalogenase Nprdha, N-Terminally Tagged.


Mono view


Stereo pair view

A full contact list of Bromine with other atoms in the Br binding site number 9 of Catabolic Reductive Dehalogenase Nprdha, N-Terminally Tagged. within 5.0Å range:
probe atom residue distance (Å) B Occ
C:Br805

b:27.9
occ:0.40
BR1 C:QSH805 0.0 27.9 0.4
BR1 C:QSB806 1.0 36.1 0.3
C02 C:QSB806 1.2 32.0 0.3
C02 C:QSH805 1.9 26.5 0.4
C03 C:QSB806 2.0 30.2 0.3
C01 C:QSB806 2.3 32.3 0.3
O10 C:QSB806 2.4 28.8 0.3
C03 C:QSH805 2.8 26.3 0.4
C01 C:QSH805 2.8 28.0 0.4
O09 C:QSH805 3.0 24.6 0.4
C04 C:QSB806 3.3 30.2 0.3
CB C:SER426 3.4 31.4 1.0
OG C:SER426 3.5 30.1 1.0
C06 C:QSB806 3.5 32.2 0.3
CB C:PRO315 3.9 37.2 1.0
C05 C:QSB806 3.9 31.3 0.3
NH1 C:ARG556 3.9 27.9 1.0
O C:HOH924 3.9 23.1 1.0
CB C:ALA423 4.0 33.3 1.0
CA C:ALA423 4.0 32.1 1.0
C04 C:QSH805 4.1 27.6 0.4
C06 C:QSH805 4.1 28.3 0.4
CB C:ALA564 4.2 35.1 1.0
SD C:MET427 4.3 43.5 1.0
CE1 C:PHE314 4.3 37.5 1.0
O C:ALA423 4.4 31.8 1.0
C05 C:QSH805 4.6 28.3 0.4
C C:ALA423 4.7 34.3 1.0
CA C:PRO315 4.8 40.0 1.0
CZ C:ARG556 4.8 27.4 1.0
C07 C:QSB806 4.8 33.3 0.3
CA C:SER426 4.8 32.6 1.0
NH2 C:ARG556 4.9 27.1 1.0
CG C:PRO315 4.9 35.6 1.0
CZ C:PHE314 5.0 37.6 1.0

Bromine binding site 10 out of 12 in 6zxx

Go back to Bromine Binding Sites List in 6zxx
Bromine binding site 10 out of 12 in the Catabolic Reductive Dehalogenase Nprdha, N-Terminally Tagged.


Mono view


Stereo pair view

A full contact list of Bromine with other atoms in the Br binding site number 10 of Catabolic Reductive Dehalogenase Nprdha, N-Terminally Tagged. within 5.0Å range:
probe atom residue distance (Å) B Occ
C:Br805

b:29.1
occ:0.40
BR2 C:QSH805 0.0 29.1 0.4
BR C:BR807 1.0 28.9 0.3
C04 C:QSH805 1.9 27.6 0.4
C04 C:QSB806 2.5 30.2 0.3
C03 C:QSH805 2.8 26.3 0.4
C05 C:QSH805 2.9 28.3 0.4
O09 C:QSH805 3.0 24.6 0.4
OH C:TYR430 3.1 37.3 1.0
C05 C:QSB806 3.1 31.3 0.3
NH2 C:ARG556 3.2 27.1 1.0
CO C:B12803 3.2 26.7 1.0
N24 C:B12803 3.3 30.0 1.0
NZ C:LYS492 3.3 34.8 1.0
C03 C:QSB806 3.5 30.2 0.3
N23 C:B12803 3.7 29.9 1.0
CE2 C:PHE295 3.8 44.0 1.0
N21 C:B12803 3.8 28.8 1.0
O10 C:QSB806 3.8 28.8 0.3
C02 C:QSH805 4.1 26.5 0.4
C06 C:QSH805 4.1 28.3 0.4
C19 C:B12803 4.2 28.9 1.0
N22 C:B12803 4.2 28.1 1.0
C16 C:B12803 4.2 28.9 1.0
CZ C:TYR430 4.3 34.5 1.0
C14 C:B12803 4.4 27.9 1.0
C06 C:QSB806 4.4 32.2 0.3
C6 C:B12803 4.4 26.6 1.0
CZ C:ARG556 4.4 27.4 1.0
CZ C:PHE295 4.4 45.1 1.0
C11 C:B12803 4.4 31.0 1.0
C4 C:B12803 4.4 26.0 1.0
OD1 C:ASN456 4.5 29.4 0.5
C1 C:B12803 4.5 29.1 1.0
C9 C:B12803 4.6 28.1 1.0
C37 C:B12803 4.6 24.5 1.0
O C:HOH936 4.6 32.9 1.0
C15 C:B12803 4.6 28.3 1.0
CE2 C:TYR430 4.6 36.6 1.0
C54 C:B12803 4.6 29.1 1.0
C01 C:QSH805 4.6 28.0 0.4
C26 C:B12803 4.6 27.9 1.0
C5 C:B12803 4.7 24.6 1.0
C02 C:QSB806 4.7 32.0 0.3
CE C:LYS492 4.7 34.0 1.0
C10 C:B12803 4.7 31.2 1.0
CD2 C:PHE295 4.7 39.9 1.0
NH1 C:ARG556 4.9 27.9 1.0

Reference:

T.Halliwell, K.Fisher, K.A.P.Payne, S.E.J.Rigby, D.Leys. Catabolic Reductive Dehalogenase Substrate Complex Structures Underpin Rational Repurposing of Substrate Scope. Microorganisms V. 8 2020.
ISSN: ISSN 2076-2607
PubMed: 32887524
DOI: 10.3390/MICROORGANISMS8091344
Page generated: Sat Dec 12 02:43:11 2020

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