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Bromine in PDB 4j9u: Crystal Structure of the Trkh/Trka Potassium Transport Complex

Protein crystallography data

The structure of Crystal Structure of the Trkh/Trka Potassium Transport Complex, PDB code: 4j9u was solved by Y.Cao, X.Jin, H.Huang, E.J.Levin, M.Zhou, New York Consortium On Membraneprotein Structure (Nycomps), with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 49.79 / 3.80
Space group P 1 21 1
Cell size a, b, c (Å), α, β, γ (°) 133.725, 146.627, 163.672, 90.00, 99.32, 90.00
R / Rfree (%) 23.2 / 28

Other elements in 4j9u:

The structure of Crystal Structure of the Trkh/Trka Potassium Transport Complex also contains other interesting chemical elements:

Potassium (K) 4 atoms
Tantalum (Ta) 108 atoms

Bromine Binding Sites:

Bromine binding site 1 out of 216 in 4j9u

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Bromine binding site 1 out of 216 in the Crystal Structure of the Trkh/Trka Potassium Transport Complex


Mono view


Stereo pair view

A full contact list of Bromine with other atoms in the Br binding site number 1 of Crystal Structure of the Trkh/Trka Potassium Transport Complex within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Br501

b:0.4
occ:0.45
BR1 A:TBR501 0.0 0.4 0.5
TA1 A:TBR501 2.6 0.3 0.5
TA2 A:TBR501 2.6 0.7 0.5
BR5 A:TBR501 3.6 91.3 0.5
BR2 A:TBR501 3.6 0.4 0.5
BR4 A:TBR501 3.7 0.5 0.5
BRC A:TBR501 3.7 0.1 0.5
CB E:GLU292 3.9 55.7 1.0
OE2 E:GLU292 4.0 87.2 1.0
O E:GLU288 4.0 53.0 1.0
TA3 A:TBR501 4.1 0.9 0.5
TA6 A:TBR501 4.2 0.4 0.5
CD E:GLU292 4.4 90.0 1.0
CA E:GLU288 4.5 81.1 1.0
C E:GLU288 4.5 74.0 1.0
CG E:GLU292 4.5 86.4 1.0
CA E:GLU292 4.6 55.6 1.0
CB E:GLU288 4.7 94.0 1.0
N E:GLU292 4.8 54.2 1.0

Bromine binding site 2 out of 216 in 4j9u

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Bromine binding site 2 out of 216 in the Crystal Structure of the Trkh/Trka Potassium Transport Complex


Mono view


Stereo pair view

A full contact list of Bromine with other atoms in the Br binding site number 2 of Crystal Structure of the Trkh/Trka Potassium Transport Complex within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Br501

b:0.4
occ:0.45
BR2 A:TBR501 0.0 0.4 0.5
TA1 A:TBR501 2.6 0.3 0.5
TA3 A:TBR501 2.6 0.9 0.5
BR3 A:TBR501 3.6 0.6 0.5
BR6 A:TBR501 3.6 0.3 0.5
BR1 A:TBR501 3.6 0.4 0.5
BR5 A:TBR501 3.7 91.3 0.5
CB E:THR291 4.1 55.3 1.0
TA5 A:TBR501 4.1 0.7 0.5
OG1 E:THR291 4.1 54.5 1.0
TA2 A:TBR501 4.2 0.7 0.5
CG2 E:THR291 4.7 56.4 1.0

Bromine binding site 3 out of 216 in 4j9u

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Bromine binding site 3 out of 216 in the Crystal Structure of the Trkh/Trka Potassium Transport Complex


Mono view


Stereo pair view

A full contact list of Bromine with other atoms in the Br binding site number 3 of Crystal Structure of the Trkh/Trka Potassium Transport Complex within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Br501

b:0.6
occ:0.45
BR3 A:TBR501 0.0 0.6 0.5
TA1 A:TBR501 2.6 0.3 0.5
TA5 A:TBR501 2.6 0.7 0.5
NZ F:LYS42 3.2 93.0 1.0
BR2 A:TBR501 3.6 0.4 0.5
BR6 A:TBR501 3.6 0.3 0.5
BR4 A:TBR501 3.6 0.5 0.5
BRB A:TBR501 3.6 0.4 0.5
TA6 A:TBR501 4.2 0.4 0.5
TA3 A:TBR501 4.2 0.9 0.5
CG F:LYS42 4.4 84.2 1.0
CE F:LYS42 4.4 85.1 1.0
CD F:LYS42 4.9 81.7 1.0

Bromine binding site 4 out of 216 in 4j9u

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Bromine binding site 4 out of 216 in the Crystal Structure of the Trkh/Trka Potassium Transport Complex


Mono view


Stereo pair view

A full contact list of Bromine with other atoms in the Br binding site number 4 of Crystal Structure of the Trkh/Trka Potassium Transport Complex within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Br501

b:0.5
occ:0.45
BR4 A:TBR501 0.0 0.5 0.5
TA6 A:TBR501 2.6 0.4 0.5
TA1 A:TBR501 2.6 0.3 0.5
BR3 A:TBR501 3.6 0.6 0.5
BRB A:TBR501 3.6 0.4 0.5
BRC A:TBR501 3.7 0.1 0.5
BR1 A:TBR501 3.7 0.4 0.5
TA5 A:TBR501 4.1 0.7 0.5
TA2 A:TBR501 4.2 0.7 0.5
CB F:ASP41 4.3 89.0 1.0
NZ F:LYS42 4.5 93.0 1.0
C F:ASP41 4.6 93.5 1.0
O F:ASP41 4.6 0.2 1.0
CG F:ASP41 4.6 90.6 1.0
CG F:LYS42 4.7 84.2 1.0
CA F:LYS42 4.7 87.2 1.0
N F:LYS42 4.7 86.5 1.0
OD2 F:ASP41 4.7 72.5 1.0
CE F:LYS42 4.8 85.1 1.0
CB F:LYS42 5.0 63.5 1.0

Bromine binding site 5 out of 216 in 4j9u

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Bromine binding site 5 out of 216 in the Crystal Structure of the Trkh/Trka Potassium Transport Complex


Mono view


Stereo pair view

A full contact list of Bromine with other atoms in the Br binding site number 5 of Crystal Structure of the Trkh/Trka Potassium Transport Complex within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Br501

b:91.3
occ:0.45
BR5 A:TBR501 0.0 91.3 0.5
TA2 A:TBR501 2.6 0.7 0.5
TA3 A:TBR501 2.6 0.9 0.5
BRA A:TBR501 3.6 0.5 0.5
BR9 A:TBR501 3.6 0.4 0.5
BR1 A:TBR501 3.6 0.4 0.5
BR2 A:TBR501 3.7 0.4 0.5
TA4 A:TBR501 4.1 86.5 0.5
TA1 A:TBR501 4.2 0.3 0.5
CA E:GLU292 4.3 55.6 1.0
CB E:GLU292 4.7 55.7 1.0
N E:GLU292 4.8 54.2 1.0
CG E:GLU292 5.0 86.4 1.0

Bromine binding site 6 out of 216 in 4j9u

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Bromine binding site 6 out of 216 in the Crystal Structure of the Trkh/Trka Potassium Transport Complex


Mono view


Stereo pair view

A full contact list of Bromine with other atoms in the Br binding site number 6 of Crystal Structure of the Trkh/Trka Potassium Transport Complex within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Br501

b:0.3
occ:0.45
BR6 A:TBR501 0.0 0.3 0.5
TA5 A:TBR501 2.6 0.7 0.5
TA3 A:TBR501 2.6 0.9 0.5
BR3 A:TBR501 3.6 0.6 0.5
BR2 A:TBR501 3.6 0.4 0.5
BR7 A:TBR501 3.6 0.5 0.5
BRA A:TBR501 3.7 0.5 0.5
TA1 A:TBR501 4.1 0.3 0.5
TA4 A:TBR501 4.2 86.5 0.5

Bromine binding site 7 out of 216 in 4j9u

Go back to Bromine Binding Sites List in 4j9u
Bromine binding site 7 out of 216 in the Crystal Structure of the Trkh/Trka Potassium Transport Complex


Mono view


Stereo pair view

A full contact list of Bromine with other atoms in the Br binding site number 7 of Crystal Structure of the Trkh/Trka Potassium Transport Complex within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Br501

b:0.5
occ:0.45
BR7 A:TBR501 0.0 0.5 0.5
TA5 A:TBR501 2.6 0.7 0.5
TA4 A:TBR501 2.6 86.5 0.5
NE2 A:HIS62 3.5 0.9 1.0
BR8 A:TBR501 3.6 0.3 0.5
BRB A:TBR501 3.6 0.4 0.5
BR6 A:TBR501 3.6 0.3 0.5
BRA A:TBR501 3.6 0.5 0.5
CE1 A:HIS62 4.1 0.6 1.0
TA3 A:TBR501 4.2 0.9 0.5
TA6 A:TBR501 4.2 0.4 0.5
O A:PRO151 4.3 94.1 1.0
CD2 A:HIS62 4.3 0.8 1.0

Bromine binding site 8 out of 216 in 4j9u

Go back to Bromine Binding Sites List in 4j9u
Bromine binding site 8 out of 216 in the Crystal Structure of the Trkh/Trka Potassium Transport Complex


Mono view


Stereo pair view

A full contact list of Bromine with other atoms in the Br binding site number 8 of Crystal Structure of the Trkh/Trka Potassium Transport Complex within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Br501

b:0.3
occ:0.45
BR8 A:TBR501 0.0 0.3 0.5
TA4 A:TBR501 2.6 86.5 0.5
TA6 A:TBR501 2.6 0.4 0.5
BR7 A:TBR501 3.6 0.5 0.5
BRB A:TBR501 3.6 0.4 0.5
BRC A:TBR501 3.6 0.1 0.5
BR9 A:TBR501 3.6 0.4 0.5
O A:PRO151 3.6 94.1 1.0
O A:LEU150 3.8 50.7 1.0
TA5 A:TBR501 4.1 0.7 0.5
TA2 A:TBR501 4.2 0.7 0.5
C A:PRO151 4.4 80.7 1.0
CA A:PRO151 4.4 67.2 1.0
C A:LEU150 4.9 59.4 1.0
O F:ASP41 4.9 0.2 1.0

Bromine binding site 9 out of 216 in 4j9u

Go back to Bromine Binding Sites List in 4j9u
Bromine binding site 9 out of 216 in the Crystal Structure of the Trkh/Trka Potassium Transport Complex


Mono view


Stereo pair view

A full contact list of Bromine with other atoms in the Br binding site number 9 of Crystal Structure of the Trkh/Trka Potassium Transport Complex within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Br501

b:0.4
occ:0.45
BR9 A:TBR501 0.0 0.4 0.5
TA4 A:TBR501 2.6 86.5 0.5
TA2 A:TBR501 2.6 0.7 0.5
BRC A:TBR501 3.5 0.1 0.5
BR5 A:TBR501 3.6 91.3 0.5
BRA A:TBR501 3.6 0.5 0.5
BR8 A:TBR501 3.6 0.3 0.5
O A:PRO151 4.1 94.1 1.0
TA6 A:TBR501 4.2 0.4 0.5
TA3 A:TBR501 4.2 0.9 0.5
O A:VAL152 4.5 97.7 1.0
N A:SER66 4.5 65.5 1.0
OG A:SER66 4.5 87.9 1.0
C A:VAL152 4.9 95.2 1.0

Bromine binding site 10 out of 216 in 4j9u

Go back to Bromine Binding Sites List in 4j9u
Bromine binding site 10 out of 216 in the Crystal Structure of the Trkh/Trka Potassium Transport Complex


Mono view


Stereo pair view

A full contact list of Bromine with other atoms in the Br binding site number 10 of Crystal Structure of the Trkh/Trka Potassium Transport Complex within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Br501

b:0.5
occ:0.45
BRA A:TBR501 0.0 0.5 0.5
TA3 A:TBR501 2.6 0.9 0.5
TA4 A:TBR501 2.6 86.5 0.5
BR5 A:TBR501 3.6 91.3 0.5
BR9 A:TBR501 3.6 0.4 0.5
BR7 A:TBR501 3.6 0.5 0.5
BR6 A:TBR501 3.7 0.3 0.5
TA2 A:TBR501 4.1 0.7 0.5
TA5 A:TBR501 4.2 0.7 0.5
O A:HIS62 4.2 79.5 1.0
C A:HIS62 4.5 91.2 1.0
CE1 A:HIS62 4.7 0.6 1.0
O A:PRO151 4.7 94.1 1.0
NE2 A:HIS62 4.8 0.9 1.0
ND1 A:HIS62 4.9 0.5 1.0

Reference:

Y.Cao, Y.Pan, H.Huang, X.Jin, E.J.Levin, B.Kloss, M.Zhou. Gating of the Trkh Ion Channel By Its Associated Rck Protein Trka. Nature V. 496 317 2013.
ISSN: ISSN 0028-0836
PubMed: 23598339
DOI: 10.1038/NATURE12056
Page generated: Wed Jul 10 21:39:42 2024

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