Dysprosium in PDB 4ll7: Structure of SHE3P Amino Terminus.
Protein crystallography data
The structure of Structure of SHE3P Amino Terminus., PDB code: 4ll7
was solved by
H.Shi,
N.Singh,
F.Esselborn,
G.Blobel,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
29.86 /
2.31
|
Space group
|
P 1
|
Cell size a, b, c (Å), α, β, γ (°)
|
28.069,
49.576,
149.950,
89.96,
84.67,
89.98
|
R / Rfree (%)
|
23.1 /
26.4
|
Other elements in 4ll7:
The structure of Structure of SHE3P Amino Terminus. also contains other interesting chemical elements:
Dysprosium Binding Sites:
Pages:
>>> Page 1 <<<
Page 2, Binding sites: 11 -
20;
Page 3, Binding sites: 21 -
30;
Binding sites:
The binding sites of Dysprosium atom in the Structure of SHE3P Amino Terminus.
(pdb code 4ll7). This binding sites where shown within
5.0 Angstroms radius around Dysprosium atom.
In total 30 binding sites of Dysprosium where determined in the
Structure of SHE3P Amino Terminus., PDB code: 4ll7:
Jump to Dysprosium binding site number:
1;
2;
3;
4;
5;
6;
7;
8;
9;
10;
Dysprosium binding site 1 out
of 30 in 4ll7
Go back to
Dysprosium Binding Sites List in 4ll7
Dysprosium binding site 1 out
of 30 in the Structure of SHE3P Amino Terminus.
 Mono view
 Stereo pair view
|
A full contact list of Dysprosium with other atoms in the Dy binding
site number 1 of Structure of SHE3P Amino Terminus. within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Dy201
b:33.0
occ:0.80
|
DY
|
A:DY201
|
0.0
|
33.0
|
0.8
|
DY
|
A:DY201
|
1.4
|
18.4
|
0.2
|
OE1
|
A:GLU128
|
2.3
|
42.4
|
1.0
|
OE1
|
B:GLU113
|
2.4
|
42.6
|
1.0
|
OE1
|
A:GLU125
|
2.5
|
38.6
|
1.0
|
OE2
|
E:GLU113
|
2.6
|
28.1
|
1.0
|
OE1
|
E:GLU113
|
2.8
|
27.7
|
1.0
|
O
|
B:HOH305
|
2.9
|
40.2
|
1.0
|
OE2
|
A:GLU128
|
2.9
|
19.0
|
1.0
|
CD
|
A:GLU128
|
3.0
|
32.1
|
1.0
|
CD
|
E:GLU113
|
3.0
|
25.9
|
1.0
|
OE2
|
A:GLU125
|
3.2
|
66.7
|
1.0
|
CD
|
A:GLU125
|
3.2
|
60.1
|
1.0
|
DY
|
E:DY202
|
3.5
|
85.7
|
0.3
|
CD
|
B:GLU113
|
3.6
|
50.0
|
1.0
|
OE2
|
B:GLU113
|
4.3
|
31.3
|
1.0
|
NZ
|
E:LYS110
|
4.3
|
44.6
|
1.0
|
O
|
B:LYS110
|
4.4
|
34.0
|
1.0
|
CG
|
A:GLU128
|
4.5
|
25.4
|
1.0
|
CG
|
E:GLU113
|
4.5
|
42.6
|
1.0
|
CG
|
B:GLU113
|
4.6
|
34.8
|
1.0
|
CG
|
A:GLU125
|
4.7
|
54.6
|
1.0
|
CB
|
B:GLU113
|
4.8
|
28.3
|
1.0
|
CA
|
B:LYS110
|
4.9
|
35.4
|
1.0
|
CB
|
B:LYS110
|
5.0
|
37.1
|
1.0
|
|
Dysprosium binding site 2 out
of 30 in 4ll7
Go back to
Dysprosium Binding Sites List in 4ll7
Dysprosium binding site 2 out
of 30 in the Structure of SHE3P Amino Terminus.
 Mono view
 Stereo pair view
|
A full contact list of Dysprosium with other atoms in the Dy binding
site number 2 of Structure of SHE3P Amino Terminus. within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Dy201
b:18.4
occ:0.20
|
DY
|
A:DY201
|
0.0
|
18.4
|
0.2
|
DY
|
A:DY201
|
1.4
|
33.0
|
0.8
|
OE2
|
E:GLU113
|
2.4
|
28.1
|
1.0
|
OE1
|
A:GLU125
|
2.4
|
38.6
|
1.0
|
DY
|
E:DY202
|
2.6
|
85.7
|
0.3
|
CD
|
E:GLU113
|
2.8
|
25.9
|
1.0
|
OE1
|
E:GLU113
|
2.9
|
27.7
|
1.0
|
OE2
|
A:GLU128
|
3.2
|
19.0
|
1.0
|
O
|
B:HOH305
|
3.3
|
40.2
|
1.0
|
OE1
|
A:GLU128
|
3.5
|
42.4
|
1.0
|
CD
|
A:GLU125
|
3.5
|
60.1
|
1.0
|
OE1
|
B:GLU113
|
3.6
|
42.6
|
1.0
|
CD
|
A:GLU128
|
3.7
|
32.1
|
1.0
|
C3
|
A:DTT212
|
3.8
|
87.7
|
1.0
|
OE2
|
A:GLU125
|
3.9
|
66.7
|
1.0
|
CG
|
E:GLU113
|
4.0
|
42.6
|
1.0
|
CG
|
B:LYS110
|
4.3
|
23.8
|
1.0
|
CB
|
E:GLU113
|
4.3
|
37.1
|
1.0
|
CB
|
B:LYS110
|
4.3
|
37.1
|
1.0
|
C2
|
A:DTT212
|
4.4
|
89.8
|
1.0
|
C1
|
A:DTT212
|
4.5
|
88.7
|
1.0
|
C4
|
A:DTT212
|
4.6
|
86.8
|
1.0
|
CA
|
B:LYS110
|
4.6
|
35.4
|
1.0
|
CD
|
B:GLU113
|
4.7
|
50.0
|
1.0
|
S4
|
A:DTT212
|
4.7
|
84.1
|
1.0
|
CG
|
A:GLU125
|
4.8
|
54.6
|
1.0
|
O
|
B:LYS110
|
4.8
|
34.0
|
1.0
|
NZ
|
B:LYS110
|
4.8
|
49.6
|
1.0
|
O3
|
A:DTT212
|
5.0
|
97.8
|
1.0
|
CD
|
B:LYS110
|
5.0
|
62.3
|
1.0
|
|
Dysprosium binding site 3 out
of 30 in 4ll7
Go back to
Dysprosium Binding Sites List in 4ll7
Dysprosium binding site 3 out
of 30 in the Structure of SHE3P Amino Terminus.
 Mono view
 Stereo pair view
|
A full contact list of Dysprosium with other atoms in the Dy binding
site number 3 of Structure of SHE3P Amino Terminus. within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Dy202
b:56.2
occ:0.23
|
OE1
|
A:GLU113
|
2.0
|
26.8
|
1.0
|
OE2
|
E:GLU125
|
2.3
|
38.4
|
1.0
|
O
|
E:HOH304
|
2.8
|
65.8
|
1.0
|
DY
|
E:DY201
|
2.8
|
13.2
|
0.2
|
CD
|
A:GLU113
|
2.9
|
42.5
|
1.0
|
CD
|
E:GLU125
|
3.0
|
18.8
|
1.0
|
DY
|
E:DY201
|
3.2
|
29.1
|
0.8
|
CG
|
E:GLU125
|
3.2
|
42.7
|
1.0
|
CG
|
A:GLU113
|
3.4
|
33.3
|
1.0
|
CB
|
A:GLU113
|
3.5
|
41.5
|
1.0
|
O
|
A:LYS110
|
3.8
|
34.5
|
1.0
|
O
|
E:HOH312
|
4.0
|
40.1
|
1.0
|
OE2
|
A:GLU113
|
4.0
|
17.9
|
1.0
|
OE1
|
E:GLU125
|
4.1
|
38.8
|
1.0
|
O
|
E:HOH313
|
4.2
|
62.7
|
1.0
|
CG
|
A:LYS114
|
4.2
|
40.2
|
1.0
|
CA
|
A:LYS110
|
4.4
|
20.7
|
1.0
|
CB
|
A:LYS110
|
4.5
|
26.7
|
1.0
|
C
|
A:LYS110
|
4.5
|
25.3
|
1.0
|
CG
|
A:LYS110
|
4.7
|
24.7
|
1.0
|
CB
|
E:GLU125
|
4.7
|
29.2
|
1.0
|
C
|
A:GLU113
|
4.7
|
29.1
|
1.0
|
N
|
A:LYS114
|
4.8
|
28.1
|
1.0
|
CA
|
A:GLU113
|
4.8
|
31.7
|
1.0
|
OE1
|
F:GLU113
|
4.8
|
42.1
|
1.0
|
OE2
|
E:GLU128
|
4.8
|
26.2
|
1.0
|
CD
|
A:LYS114
|
4.9
|
58.7
|
1.0
|
|
Dysprosium binding site 4 out
of 30 in 4ll7
Go back to
Dysprosium Binding Sites List in 4ll7
Dysprosium binding site 4 out
of 30 in the Structure of SHE3P Amino Terminus.
 Mono view
 Stereo pair view
|
A full contact list of Dysprosium with other atoms in the Dy binding
site number 4 of Structure of SHE3P Amino Terminus. within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Dy203
b:71.4
occ:0.16
|
OE2
|
A:GLU103
|
2.4
|
69.7
|
1.0
|
CD
|
A:GLU103
|
3.4
|
64.7
|
1.0
|
OE1
|
A:GLU103
|
3.7
|
64.1
|
1.0
|
OE2
|
A:GLU96
|
3.8
|
65.9
|
1.0
|
O
|
A:HOH319
|
4.5
|
44.9
|
1.0
|
CG
|
A:GLU103
|
4.7
|
42.5
|
1.0
|
CD
|
A:GLU96
|
4.7
|
78.3
|
1.0
|
OD1
|
F:ASN124
|
4.8
|
45.4
|
1.0
|
OE1
|
A:GLU96
|
4.9
|
90.7
|
1.0
|
|
Dysprosium binding site 5 out
of 30 in 4ll7
Go back to
Dysprosium Binding Sites List in 4ll7
Dysprosium binding site 5 out
of 30 in the Structure of SHE3P Amino Terminus.
 Mono view
 Stereo pair view
|
A full contact list of Dysprosium with other atoms in the Dy binding
site number 5 of Structure of SHE3P Amino Terminus. within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Dy204
b:71.5
occ:0.26
|
OD1
|
A:ASP115
|
2.8
|
35.6
|
1.0
|
O4
|
G:SO4204
|
3.0
|
0.6
|
1.0
|
O
|
A:HOH320
|
3.1
|
65.7
|
1.0
|
OD2
|
A:ASP115
|
3.3
|
39.7
|
1.0
|
CG
|
A:ASP115
|
3.4
|
38.5
|
1.0
|
NZ
|
G:LYS105
|
4.1
|
26.9
|
1.0
|
S
|
G:SO4204
|
4.2
|
1.0
|
1.0
|
O2
|
G:SO4204
|
4.2
|
99.3
|
1.0
|
O3
|
G:SO4204
|
4.8
|
0.9
|
1.0
|
CB
|
A:ASP115
|
4.9
|
39.3
|
1.0
|
OE1
|
A:GLU111
|
5.0
|
57.3
|
1.0
|
|
Dysprosium binding site 6 out
of 30 in 4ll7
Go back to
Dysprosium Binding Sites List in 4ll7
Dysprosium binding site 6 out
of 30 in the Structure of SHE3P Amino Terminus.
 Mono view
 Stereo pair view
|
A full contact list of Dysprosium with other atoms in the Dy binding
site number 6 of Structure of SHE3P Amino Terminus. within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Dy201
b:63.4
occ:0.33
|
OD1
|
B:ASP115
|
2.4
|
52.4
|
1.0
|
CG
|
B:ASP115
|
3.2
|
41.2
|
1.0
|
OD2
|
B:ASP115
|
3.3
|
46.1
|
1.0
|
O2
|
H:EDO206
|
4.6
|
44.1
|
1.0
|
CB
|
B:ASP115
|
4.7
|
21.3
|
1.0
|
CG
|
B:GLU111
|
4.7
|
53.8
|
1.0
|
NZ
|
H:LYS105
|
4.8
|
31.5
|
1.0
|
O
|
B:GLU111
|
4.9
|
32.2
|
1.0
|
OE2
|
B:GLU111
|
4.9
|
68.5
|
1.0
|
O1
|
B:SO4207
|
4.9
|
0.6
|
1.0
|
|
Dysprosium binding site 7 out
of 30 in 4ll7
Go back to
Dysprosium Binding Sites List in 4ll7
Dysprosium binding site 7 out
of 30 in the Structure of SHE3P Amino Terminus.
 Mono view
 Stereo pair view
|
A full contact list of Dysprosium with other atoms in the Dy binding
site number 7 of Structure of SHE3P Amino Terminus. within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Dy202
b:73.0
occ:0.20
|
O
|
B:HOH321
|
2.6
|
63.7
|
1.0
|
OE2
|
B:GLU103
|
2.6
|
57.9
|
1.0
|
OE1
|
B:GLU103
|
2.9
|
52.9
|
1.0
|
CD
|
B:GLU103
|
3.1
|
41.9
|
1.0
|
OE2
|
B:GLU96
|
4.0
|
63.3
|
1.0
|
OG
|
B:SER100
|
4.6
|
58.0
|
1.0
|
O
|
B:HOH308
|
4.6
|
36.3
|
1.0
|
CG
|
B:GLU103
|
4.6
|
19.3
|
1.0
|
OD1
|
E:ASN124
|
4.8
|
50.2
|
1.0
|
O
|
F:HOH318
|
4.8
|
46.8
|
1.0
|
CA
|
B:SER100
|
4.9
|
19.4
|
1.0
|
|
Dysprosium binding site 8 out
of 30 in 4ll7
Go back to
Dysprosium Binding Sites List in 4ll7
Dysprosium binding site 8 out
of 30 in the Structure of SHE3P Amino Terminus.
 Mono view
 Stereo pair view
|
A full contact list of Dysprosium with other atoms in the Dy binding
site number 8 of Structure of SHE3P Amino Terminus. within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Dy203
b:67.0
occ:0.25
|
OE1
|
B:GLU128
|
2.1
|
67.9
|
1.0
|
O
|
B:HOH322
|
2.9
|
68.7
|
1.0
|
CD
|
B:GLU128
|
3.3
|
74.4
|
1.0
|
OE2
|
B:GLU128
|
3.7
|
66.5
|
1.0
|
CG
|
B:GLU125
|
4.4
|
67.2
|
1.0
|
CG
|
B:GLU128
|
4.5
|
49.6
|
1.0
|
OE2
|
B:GLU125
|
4.6
|
93.1
|
1.0
|
CB
|
B:GLU128
|
5.0
|
46.3
|
1.0
|
|
Dysprosium binding site 9 out
of 30 in 4ll7
Go back to
Dysprosium Binding Sites List in 4ll7
Dysprosium binding site 9 out
of 30 in the Structure of SHE3P Amino Terminus.
 Mono view
 Stereo pair view
|
A full contact list of Dysprosium with other atoms in the Dy binding
site number 9 of Structure of SHE3P Amino Terminus. within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
C:Dy201
b:35.4
occ:0.80
|
DY
|
C:DY201
|
0.0
|
35.4
|
0.8
|
DY
|
C:DY201
|
1.3
|
18.2
|
0.2
|
OE1
|
C:GLU128
|
2.2
|
46.0
|
1.0
|
O
|
C:HOH321
|
2.4
|
17.2
|
1.0
|
CD
|
C:GLU128
|
3.0
|
26.9
|
1.0
|
OE2
|
C:GLU128
|
3.0
|
17.6
|
1.0
|
OE1
|
C:GLU125
|
3.0
|
52.6
|
1.0
|
OE2
|
C:GLU125
|
3.1
|
71.8
|
1.0
|
CD
|
C:GLU125
|
3.2
|
53.2
|
1.0
|
CG
|
C:GLU125
|
4.3
|
51.8
|
1.0
|
CG
|
C:GLU128
|
4.4
|
18.1
|
1.0
|
O
|
C:HOH304
|
5.0
|
43.0
|
1.0
|
CB
|
C:GLU128
|
5.0
|
23.9
|
1.0
|
|
Dysprosium binding site 10 out
of 30 in 4ll7
Go back to
Dysprosium Binding Sites List in 4ll7
Dysprosium binding site 10 out
of 30 in the Structure of SHE3P Amino Terminus.
 Mono view
 Stereo pair view
|
A full contact list of Dysprosium with other atoms in the Dy binding
site number 10 of Structure of SHE3P Amino Terminus. within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
C:Dy201
b:18.2
occ:0.20
|
DY
|
C:DY201
|
0.0
|
18.2
|
0.2
|
DY
|
C:DY201
|
1.3
|
35.4
|
0.8
|
O
|
C:HOH321
|
2.3
|
17.2
|
1.0
|
OE2
|
C:GLU128
|
3.0
|
17.6
|
1.0
|
OE1
|
C:GLU128
|
3.0
|
46.0
|
1.0
|
CD
|
C:GLU128
|
3.4
|
26.9
|
1.0
|
OE2
|
C:GLU125
|
3.5
|
71.8
|
1.0
|
CD
|
C:GLU125
|
3.6
|
53.2
|
1.0
|
OE1
|
C:GLU125
|
3.7
|
52.6
|
1.0
|
O
|
C:HOH304
|
3.9
|
43.0
|
1.0
|
CG
|
C:GLU125
|
4.3
|
51.8
|
1.0
|
CG
|
C:GLU128
|
4.9
|
18.1
|
1.0
|
|
Reference:
H.Shi,
N.Singh,
F.Esselborn,
G.Blobel.
Structure of A Myosinbulletadaptor Complex and Pairing By Cargo. Proc.Natl.Acad.Sci.Usa V. 111 E1082 2014.
ISSN: ISSN 0027-8424
PubMed: 24522109
DOI: 10.1073/PNAS.1401428111
Page generated: Wed Jul 31 10:35:09 2024
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