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Bromine in PDB 5eul: Structure of the Seca-Secy Complex with A Translocating Polypeptide Substrate

Protein crystallography data

The structure of Structure of the Seca-Secy Complex with A Translocating Polypeptide Substrate, PDB code: 5eul was solved by L.Li, E.Park, J.Ling, J.Ingram, H.Ploegh, T.A.Rapoport, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 53.85 / 3.70
Space group P 61 2 2
Cell size a, b, c (Å), α, β, γ (°) 127.798, 127.798, 554.772, 90.00, 90.00, 120.00
R / Rfree (%) 29.5 / 31.5

Other elements in 5eul:

The structure of Structure of the Seca-Secy Complex with A Translocating Polypeptide Substrate also contains other interesting chemical elements:

Fluorine (F) 3 atoms
Magnesium (Mg) 1 atom
Tantalum (Ta) 108 atoms

Bromine Binding Sites:

Bromine binding site 1 out of 216 in 5eul

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Bromine binding site 1 out of 216 in the Structure of the Seca-Secy Complex with A Translocating Polypeptide Substrate


Mono view


Stereo pair view

A full contact list of Bromine with other atoms in the Br binding site number 1 of Structure of the Seca-Secy Complex with A Translocating Polypeptide Substrate within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Br1004

b:0.8
occ:0.93
BR1 A:TBR1004 0.0 0.8 0.9
TA2 A:TBR1004 2.6 0.6 0.9
TA1 A:TBR1004 2.6 0.9 0.9
OE1 A:GLN598 3.5 0.7 1.0
BR2 A:TBR1004 3.6 0.9 0.9
BR5 A:TBR1004 3.6 0.5 0.9
BRC A:TBR1004 3.6 0.3 0.9
BR4 A:TBR1004 3.7 0.1 0.9
TA3 A:TBR1004 4.2 0.0 0.9
OE1 Y:GLU103 4.2 0.4 1.0
TA6 A:TBR1004 4.2 0.1 0.9
CD A:GLN598 4.4 0.5 1.0
NE2 A:GLN598 4.5 0.7 1.0
CB A:LYS594 4.5 0.6 1.0
NZ A:LYS594 4.8 0.8 1.0

Bromine binding site 2 out of 216 in 5eul

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Bromine binding site 2 out of 216 in the Structure of the Seca-Secy Complex with A Translocating Polypeptide Substrate


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Stereo pair view

A full contact list of Bromine with other atoms in the Br binding site number 2 of Structure of the Seca-Secy Complex with A Translocating Polypeptide Substrate within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Br1004

b:0.9
occ:0.93
BR2 A:TBR1004 0.0 0.9 0.9
TA1 A:TBR1004 2.6 0.9 0.9
TA3 A:TBR1004 2.6 0.0 0.9
CB A:GLN595 3.5 0.7 1.0
BR1 A:TBR1004 3.6 0.8 0.9
BR3 A:TBR1004 3.6 0.1 0.9
BR5 A:TBR1004 3.6 0.5 0.9
BR6 A:TBR1004 3.6 0.8 0.9
O A:ASP591 3.7 0.7 1.0
CA A:GLN595 3.9 0.9 1.0
CG A:GLN595 4.0 0.9 1.0
N A:GLN595 4.1 0.6 1.0
TA2 A:TBR1004 4.1 0.6 0.9
TA5 A:TBR1004 4.2 0.2 0.9
CD A:GLN595 4.3 0.4 1.0
OE1 A:GLN595 4.5 0.4 1.0
C A:ASP591 4.6 0.5 1.0
NE2 A:GLN598 4.8 0.7 1.0
NE2 A:GLN595 4.8 0.9 1.0
C A:LYS594 4.9 0.1 1.0
CB A:ASP591 5.0 0.7 1.0

Bromine binding site 3 out of 216 in 5eul

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Bromine binding site 3 out of 216 in the Structure of the Seca-Secy Complex with A Translocating Polypeptide Substrate


Mono view


Stereo pair view

A full contact list of Bromine with other atoms in the Br binding site number 3 of Structure of the Seca-Secy Complex with A Translocating Polypeptide Substrate within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Br1004

b:0.1
occ:0.93
BR3 A:TBR1004 0.0 0.1 0.9
TA1 A:TBR1004 2.6 0.9 0.9
TA5 A:TBR1004 2.6 0.2 0.9
OH A:TYR599 3.5 0.9 1.0
BR6 A:TBR1004 3.6 0.8 0.9
BR4 A:TBR1004 3.6 0.1 0.9
BR2 A:TBR1004 3.6 0.9 0.9
BRB A:TBR1004 3.6 0.4 0.9
TA3 A:TBR1004 4.2 0.0 0.9
TA6 A:TBR1004 4.2 0.1 0.9
NE2 A:GLN598 4.2 0.7 1.0
CZ A:TYR599 4.5 0.6 1.0
ND1 A:HIS739 4.7 0.6 1.0
NE2 A:GLN595 4.8 0.9 1.0
CG A:GLN595 4.9 0.9 1.0

Bromine binding site 4 out of 216 in 5eul

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Bromine binding site 4 out of 216 in the Structure of the Seca-Secy Complex with A Translocating Polypeptide Substrate


Mono view


Stereo pair view

A full contact list of Bromine with other atoms in the Br binding site number 4 of Structure of the Seca-Secy Complex with A Translocating Polypeptide Substrate within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Br1004

b:0.1
occ:0.93
BR4 A:TBR1004 0.0 0.1 0.9
TA6 A:TBR1004 2.6 0.1 0.9
TA1 A:TBR1004 2.6 0.9 0.9
BR3 A:TBR1004 3.6 0.1 0.9
BRB A:TBR1004 3.6 0.4 0.9
BRC A:TBR1004 3.7 0.3 0.9
BR1 A:TBR1004 3.7 0.8 0.9
NE2 A:GLN598 3.8 0.7 1.0
TA5 A:TBR1004 4.2 0.2 0.9
TA2 A:TBR1004 4.2 0.6 0.9
OE1 A:GLN598 4.2 0.7 1.0
CD A:GLN598 4.4 0.5 1.0
CD1 A:LEU796 5.0 0.5 1.0

Bromine binding site 5 out of 216 in 5eul

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Bromine binding site 5 out of 216 in the Structure of the Seca-Secy Complex with A Translocating Polypeptide Substrate


Mono view


Stereo pair view

A full contact list of Bromine with other atoms in the Br binding site number 5 of Structure of the Seca-Secy Complex with A Translocating Polypeptide Substrate within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Br1004

b:0.5
occ:0.93
BR5 A:TBR1004 0.0 0.5 0.9
TA2 A:TBR1004 2.6 0.6 0.9
TA3 A:TBR1004 2.6 0.0 0.9
OD2 A:ASP591 3.3 0.9 1.0
N Y:GLU103 3.3 0.8 1.0
BR1 A:TBR1004 3.6 0.8 0.9
BR9 A:TBR1004 3.6 0.5 0.9
BRA A:TBR1004 3.6 0.5 0.9
CG A:ASP591 3.6 0.0 1.0
BR2 A:TBR1004 3.6 0.9 0.9
CB A:ASP591 3.8 0.7 1.0
CA Y:GLU103 4.0 0.2 1.0
CB Y:GLU103 4.0 1.0 1.0
C Y:GLY102 4.1 0.5 1.0
TA4 A:TBR1004 4.2 0.8 0.9
TA1 A:TBR1004 4.2 0.9 0.9
OD1 A:ASP591 4.3 0.2 1.0
CA Y:GLY102 4.4 0.2 1.0
OE1 Y:GLU103 4.4 0.4 1.0
CA A:ASP591 4.5 0.3 1.0
O A:ASP591 5.0 0.7 1.0

Bromine binding site 6 out of 216 in 5eul

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Bromine binding site 6 out of 216 in the Structure of the Seca-Secy Complex with A Translocating Polypeptide Substrate


Mono view


Stereo pair view

A full contact list of Bromine with other atoms in the Br binding site number 6 of Structure of the Seca-Secy Complex with A Translocating Polypeptide Substrate within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Br1004

b:0.8
occ:0.93
BR6 A:TBR1004 0.0 0.8 0.9
TA5 A:TBR1004 2.6 0.2 0.9
TA3 A:TBR1004 2.6 0.0 0.9
BR3 A:TBR1004 3.6 0.1 0.9
BR7 A:TBR1004 3.6 0.6 0.9
BR2 A:TBR1004 3.6 0.9 0.9
BRA A:TBR1004 3.7 0.5 0.9
TA1 A:TBR1004 4.1 0.9 0.9
TA4 A:TBR1004 4.2 0.8 0.9
NE2 A:GLN595 4.5 0.9 1.0
CD A:GLN595 4.9 0.4 1.0

Bromine binding site 7 out of 216 in 5eul

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Bromine binding site 7 out of 216 in the Structure of the Seca-Secy Complex with A Translocating Polypeptide Substrate


Mono view


Stereo pair view

A full contact list of Bromine with other atoms in the Br binding site number 7 of Structure of the Seca-Secy Complex with A Translocating Polypeptide Substrate within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Br1004

b:0.6
occ:0.93
BR7 A:TBR1004 0.0 0.6 0.9
TA5 A:TBR1004 2.6 0.2 0.9
TA4 A:TBR1004 2.6 0.8 0.9
BR8 A:TBR1004 3.6 0.7 0.9
BRB A:TBR1004 3.6 0.4 0.9
BR6 A:TBR1004 3.6 0.8 0.9
BRA A:TBR1004 3.7 0.5 0.9
O A:LEU740 3.8 0.2 1.0
TA6 A:TBR1004 4.2 0.1 0.9
TA3 A:TBR1004 4.2 0.0 0.9
CA A:ARG741 4.9 0.9 1.0
C A:LEU740 4.9 0.2 1.0

Bromine binding site 8 out of 216 in 5eul

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Bromine binding site 8 out of 216 in the Structure of the Seca-Secy Complex with A Translocating Polypeptide Substrate


Mono view


Stereo pair view

A full contact list of Bromine with other atoms in the Br binding site number 8 of Structure of the Seca-Secy Complex with A Translocating Polypeptide Substrate within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Br1004

b:0.7
occ:0.93
BR8 A:TBR1004 0.0 0.7 0.9
TA4 A:TBR1004 2.6 0.8 0.9
TA6 A:TBR1004 2.6 0.1 0.9
BR7 A:TBR1004 3.6 0.6 0.9
BRB A:TBR1004 3.6 0.4 0.9
BR9 A:TBR1004 3.6 0.5 0.9
BRC A:TBR1004 3.6 0.3 0.9
TA5 A:TBR1004 4.2 0.2 0.9
TA2 A:TBR1004 4.2 0.6 0.9

Bromine binding site 9 out of 216 in 5eul

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Bromine binding site 9 out of 216 in the Structure of the Seca-Secy Complex with A Translocating Polypeptide Substrate


Mono view


Stereo pair view

A full contact list of Bromine with other atoms in the Br binding site number 9 of Structure of the Seca-Secy Complex with A Translocating Polypeptide Substrate within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Br1004

b:0.5
occ:0.93
BR9 A:TBR1004 0.0 0.5 0.9
TA4 A:TBR1004 2.6 0.8 0.9
TA2 A:TBR1004 2.6 0.6 0.9
N Y:GLU103 3.4 0.8 1.0
BRC A:TBR1004 3.6 0.3 0.9
BRA A:TBR1004 3.6 0.5 0.9
BR5 A:TBR1004 3.6 0.5 0.9
BR8 A:TBR1004 3.6 0.7 0.9
TA3 A:TBR1004 4.2 0.0 0.9
TA6 A:TBR1004 4.2 0.1 0.9
CA Y:GLY102 4.2 0.2 1.0
C Y:GLY102 4.2 0.5 1.0
CB Y:ARG106 4.2 0.4 1.0
CA Y:GLU103 4.2 0.2 1.0
N Y:ARG106 4.6 0.5 1.0

Bromine binding site 10 out of 216 in 5eul

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Bromine binding site 10 out of 216 in the Structure of the Seca-Secy Complex with A Translocating Polypeptide Substrate


Mono view


Stereo pair view

A full contact list of Bromine with other atoms in the Br binding site number 10 of Structure of the Seca-Secy Complex with A Translocating Polypeptide Substrate within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Br1004

b:0.5
occ:0.93
BRA A:TBR1004 0.0 0.5 0.9
TA3 A:TBR1004 2.6 0.0 0.9
TA4 A:TBR1004 2.6 0.8 0.9
BR9 A:TBR1004 3.6 0.5 0.9
BR5 A:TBR1004 3.6 0.5 0.9
BR6 A:TBR1004 3.7 0.8 0.9
BR7 A:TBR1004 3.7 0.6 0.9
NH2 A:ARG741 3.9 0.2 1.0
TA2 A:TBR1004 4.2 0.6 0.9
TA5 A:TBR1004 4.2 0.2 0.9
CA Y:GLY102 4.2 0.2 1.0
O Y:GLN101 4.8 0.8 1.0
CZ A:ARG741 4.9 0.6 1.0
N Y:GLU103 4.9 0.8 1.0

Reference:

L.Li, E.Park, J.Ling, J.Ingram, H.Ploegh, T.A.Rapoport. Crystal Structure of A Substrate-Engaged Secy Protein-Translocation Channel. Nature V. 531 395 2016.
ISSN: ESSN 1476-4687
PubMed: 26950603
DOI: 10.1038/NATURE17163
Page generated: Sat Dec 12 02:25:43 2020

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