Caesium in PDB 4eeb: Cora Coiled-Coil Mutant Under MG2+ Absence
Protein crystallography data
The structure of Cora Coiled-Coil Mutant Under MG2+ Absence, PDB code: 4eeb
was solved by
R.Pfoh,
E.F.Pai,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
19.92 /
3.80
|
Space group
|
P 21 21 2
|
Cell size a, b, c (Å), α, β, γ (°)
|
125.600,
221.900,
106.800,
90.00,
90.00,
90.00
|
R / Rfree (%)
|
29.9 /
34.3
|
Other elements in 4eeb:
The structure of Cora Coiled-Coil Mutant Under MG2+ Absence also contains other interesting chemical elements:
Caesium Binding Sites:
The binding sites of Caesium atom in the Cora Coiled-Coil Mutant Under MG2+ Absence
(pdb code 4eeb). This binding sites where shown within
5.0 Angstroms radius around Caesium atom.
In total 9 binding sites of Caesium where determined in the
Cora Coiled-Coil Mutant Under MG2+ Absence, PDB code: 4eeb:
Jump to Caesium binding site number:
1;
2;
3;
4;
5;
6;
7;
8;
9;
Caesium binding site 1 out
of 9 in 4eeb
Go back to
Caesium Binding Sites List in 4eeb
Caesium binding site 1 out
of 9 in the Cora Coiled-Coil Mutant Under MG2+ Absence
Mono view
Stereo pair view
|
A full contact list of Caesium with other atoms in the Cs binding
site number 1 of Cora Coiled-Coil Mutant Under MG2+ Absence within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Cs401
b:0.3
occ:0.80
|
ND2
|
A:ASN314
|
3.0
|
0.9
|
1.0
|
ND2
|
E:ASN314
|
3.7
|
0.7
|
1.0
|
OD1
|
E:ASN314
|
3.7
|
0.5
|
1.0
|
OD1
|
A:ASN314
|
3.8
|
0.9
|
1.0
|
CG
|
A:ASN314
|
3.9
|
1.0
|
1.0
|
ND2
|
D:ASN314
|
4.0
|
0.1
|
1.0
|
CG
|
E:ASN314
|
4.1
|
0.7
|
1.0
|
O
|
E:GLY312
|
4.2
|
0.5
|
1.0
|
OD1
|
C:ASN314
|
4.2
|
0.7
|
1.0
|
O
|
A:GLY312
|
4.3
|
0.7
|
1.0
|
ND2
|
C:ASN314
|
4.3
|
0.1
|
1.0
|
OD1
|
D:ASN314
|
4.4
|
0.2
|
1.0
|
O
|
D:GLY312
|
4.5
|
0.4
|
1.0
|
C
|
A:GLY312
|
4.6
|
0.1
|
1.0
|
CG
|
C:ASN314
|
4.7
|
0.8
|
1.0
|
CG
|
D:ASN314
|
4.7
|
0.1
|
1.0
|
CA
|
A:GLY312
|
4.7
|
0.1
|
1.0
|
C
|
E:GLY312
|
4.9
|
0.5
|
1.0
|
|
Caesium binding site 2 out
of 9 in 4eeb
Go back to
Caesium Binding Sites List in 4eeb
Caesium binding site 2 out
of 9 in the Cora Coiled-Coil Mutant Under MG2+ Absence
Mono view
Stereo pair view
|
A full contact list of Caesium with other atoms in the Cs binding
site number 2 of Cora Coiled-Coil Mutant Under MG2+ Absence within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Cs1001
b:0.7
occ:0.50
|
OD1
|
C:ASP89
|
3.0
|
0.9
|
1.0
|
CE1
|
B:HIS257
|
3.2
|
0.6
|
1.0
|
NE2
|
B:HIS257
|
3.5
|
0.1
|
1.0
|
OE1
|
C:GLN95
|
3.7
|
0.9
|
1.0
|
ND1
|
B:HIS257
|
3.9
|
0.3
|
1.0
|
CG
|
C:ASP89
|
4.2
|
0.4
|
1.0
|
OE2
|
C:GLU88
|
4.3
|
0.9
|
1.0
|
ND2
|
C:ASN92
|
4.4
|
0.1
|
1.0
|
CD2
|
B:HIS257
|
4.4
|
0.1
|
1.0
|
CG
|
C:ASN92
|
4.4
|
0.2
|
1.0
|
CB
|
C:ASN92
|
4.5
|
0.7
|
1.0
|
OD2
|
B:ASP253
|
4.6
|
0.9
|
1.0
|
OD1
|
B:ASP253
|
4.6
|
0.3
|
1.0
|
CG
|
B:HIS257
|
4.6
|
0.3
|
1.0
|
CA
|
C:ASP89
|
4.7
|
0.8
|
1.0
|
CD
|
C:GLN95
|
4.7
|
0.2
|
1.0
|
OD1
|
C:ASN92
|
4.9
|
0.7
|
1.0
|
CG
|
B:ASP253
|
5.0
|
0.8
|
1.0
|
|
Caesium binding site 3 out
of 9 in 4eeb
Go back to
Caesium Binding Sites List in 4eeb
Caesium binding site 3 out
of 9 in the Cora Coiled-Coil Mutant Under MG2+ Absence
Mono view
Stereo pair view
|
A full contact list of Caesium with other atoms in the Cs binding
site number 3 of Cora Coiled-Coil Mutant Under MG2+ Absence within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Cs1003
b:0.9
occ:0.50
|
OD2
|
B:ASP189
|
3.5
|
0.1
|
1.0
|
OE1
|
B:GLU186
|
3.8
|
0.2
|
1.0
|
CG
|
B:ASP189
|
4.2
|
0.2
|
1.0
|
CG
|
B:GLU186
|
4.3
|
0.0
|
1.0
|
CA
|
B:GLU186
|
4.3
|
0.9
|
1.0
|
CB
|
B:ASP189
|
4.3
|
0.7
|
1.0
|
CD
|
B:GLU186
|
4.5
|
0.7
|
1.0
|
CB
|
B:GLU186
|
4.6
|
0.1
|
1.0
|
N
|
B:GLU186
|
4.8
|
0.9
|
1.0
|
O
|
B:LEU185
|
5.0
|
0.2
|
1.0
|
|
Caesium binding site 4 out
of 9 in 4eeb
Go back to
Caesium Binding Sites List in 4eeb
Caesium binding site 4 out
of 9 in the Cora Coiled-Coil Mutant Under MG2+ Absence
Mono view
Stereo pair view
|
A full contact list of Caesium with other atoms in the Cs binding
site number 4 of Cora Coiled-Coil Mutant Under MG2+ Absence within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Cs1004
b:0.5
occ:0.50
|
OD1
|
B:ASP190
|
3.1
|
0.7
|
1.0
|
OD2
|
B:ASP190
|
3.5
|
0.9
|
1.0
|
CG
|
B:ASP190
|
3.5
|
0.2
|
1.0
|
CB
|
B:ASP190
|
4.8
|
0.3
|
1.0
|
|
Caesium binding site 5 out
of 9 in 4eeb
Go back to
Caesium Binding Sites List in 4eeb
Caesium binding site 5 out
of 9 in the Cora Coiled-Coil Mutant Under MG2+ Absence
Mono view
Stereo pair view
|
A full contact list of Caesium with other atoms in the Cs binding
site number 5 of Cora Coiled-Coil Mutant Under MG2+ Absence within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
C:Cs401
b:0.1
occ:0.50
|
OD2
|
C:ASP253
|
2.8
|
0.6
|
1.0
|
CG
|
C:ASP253
|
3.6
|
0.7
|
1.0
|
OH
|
C:TYR171
|
3.8
|
0.5
|
1.0
|
OD1
|
C:ASP253
|
3.9
|
0.3
|
1.0
|
CD2
|
D:LEU85
|
4.1
|
0.0
|
1.0
|
CB
|
C:ASP253
|
4.7
|
0.5
|
1.0
|
|
Caesium binding site 6 out
of 9 in 4eeb
Go back to
Caesium Binding Sites List in 4eeb
Caesium binding site 6 out
of 9 in the Cora Coiled-Coil Mutant Under MG2+ Absence
Mono view
Stereo pair view
|
A full contact list of Caesium with other atoms in the Cs binding
site number 6 of Cora Coiled-Coil Mutant Under MG2+ Absence within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
D:Cs1001
b:0.0
occ:0.50
|
ND2
|
E:ASN92
|
3.1
|
0.1
|
1.0
|
CE1
|
D:HIS257
|
3.3
|
0.7
|
1.0
|
CD
|
E:GLN95
|
3.8
|
0.7
|
1.0
|
OE1
|
E:GLN95
|
3.8
|
0.0
|
1.0
|
NE2
|
E:GLN95
|
4.0
|
0.9
|
1.0
|
CG
|
E:ASN92
|
4.0
|
0.7
|
1.0
|
ND1
|
D:HIS257
|
4.1
|
0.2
|
1.0
|
CB
|
E:ASN92
|
4.1
|
0.1
|
1.0
|
NE2
|
D:HIS257
|
4.2
|
0.8
|
1.0
|
OD1
|
E:ASP89
|
4.3
|
0.7
|
1.0
|
CG
|
E:GLN95
|
4.4
|
0.4
|
1.0
|
OE2
|
E:GLU88
|
4.5
|
0.6
|
1.0
|
OD1
|
D:ASP253
|
4.7
|
0.1
|
1.0
|
CA
|
E:ASP89
|
4.8
|
0.0
|
1.0
|
CG
|
E:ASP89
|
4.8
|
0.3
|
1.0
|
|
Caesium binding site 7 out
of 9 in 4eeb
Go back to
Caesium Binding Sites List in 4eeb
Caesium binding site 7 out
of 9 in the Cora Coiled-Coil Mutant Under MG2+ Absence
Mono view
Stereo pair view
|
A full contact list of Caesium with other atoms in the Cs binding
site number 7 of Cora Coiled-Coil Mutant Under MG2+ Absence within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
E:Cs401
b:0.5
occ:0.50
|
NE2
|
E:GLN213
|
4.7
|
0.5
|
1.0
|
OE1
|
E:GLU121
|
4.9
|
0.8
|
1.0
|
|
Caesium binding site 8 out
of 9 in 4eeb
Go back to
Caesium Binding Sites List in 4eeb
Caesium binding site 8 out
of 9 in the Cora Coiled-Coil Mutant Under MG2+ Absence
Mono view
Stereo pair view
|
A full contact list of Caesium with other atoms in the Cs binding
site number 8 of Cora Coiled-Coil Mutant Under MG2+ Absence within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
E:Cs402
b:0.2
occ:0.50
|
OD1
|
A:ASP89
|
2.7
|
0.8
|
1.0
|
OD1
|
E:ASP253
|
2.8
|
0.2
|
1.0
|
OD2
|
E:ASP253
|
3.0
|
0.5
|
1.0
|
CG
|
E:ASP253
|
3.2
|
0.6
|
1.0
|
CG
|
A:ASP89
|
3.4
|
0.2
|
1.0
|
OE2
|
A:GLU88
|
3.5
|
0.3
|
1.0
|
OD2
|
A:ASP89
|
3.5
|
0.2
|
1.0
|
O
|
A:LEU85
|
3.6
|
0.6
|
1.0
|
NE2
|
E:HIS257
|
3.9
|
0.7
|
1.0
|
CD2
|
A:LEU85
|
4.0
|
0.1
|
1.0
|
CE1
|
E:HIS257
|
4.1
|
0.6
|
1.0
|
C
|
A:LEU85
|
4.5
|
0.1
|
1.0
|
CB
|
E:ASP253
|
4.5
|
0.1
|
1.0
|
CD
|
A:GLU88
|
4.5
|
0.5
|
1.0
|
CB
|
A:ASP89
|
4.6
|
0.8
|
1.0
|
CB
|
A:GLU88
|
4.6
|
0.2
|
1.0
|
CA
|
A:LEU85
|
4.6
|
0.9
|
1.0
|
N
|
A:ASP89
|
4.7
|
0.1
|
1.0
|
CB
|
A:LEU85
|
4.7
|
0.7
|
1.0
|
CG
|
A:GLU88
|
4.8
|
0.9
|
1.0
|
CA
|
A:ASP89
|
4.9
|
0.4
|
1.0
|
CG
|
A:LEU85
|
5.0
|
0.1
|
1.0
|
|
Caesium binding site 9 out
of 9 in 4eeb
Go back to
Caesium Binding Sites List in 4eeb
Caesium binding site 9 out
of 9 in the Cora Coiled-Coil Mutant Under MG2+ Absence
Mono view
Stereo pair view
|
A full contact list of Caesium with other atoms in the Cs binding
site number 9 of Cora Coiled-Coil Mutant Under MG2+ Absence within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
E:Cs403
b:0.4
occ:0.50
|
OD2
|
E:ASP193
|
4.6
|
0.9
|
1.0
|
OE2
|
A:GLU121
|
4.9
|
0.9
|
1.0
|
OD1
|
E:ASP193
|
4.9
|
0.1
|
1.0
|
|
Reference:
R.Pfoh,
A.Li,
N.Chakrabarti,
J.Payandeh,
R.Pomes,
E.F.Pai.
Structural Asymmetry in the Magnesium Channel Cora Points to Sequential Allosteric Regulation. Proc.Natl.Acad.Sci.Usa V. 109 18809 2012.
ISSN: ISSN 0027-8424
PubMed: 23112165
DOI: 10.1073/PNAS.1209018109
Page generated: Tue Jul 30 20:27:41 2024
|