Zinc in PDB 5tte: Crystal Structure of An Rbr E3 Ubiquitin Ligase in Complex with An E2- Ub Thioester Intermediate Mimic
Enzymatic activity of Crystal Structure of An Rbr E3 Ubiquitin Ligase in Complex with An E2- Ub Thioester Intermediate Mimic
All present enzymatic activity of Crystal Structure of An Rbr E3 Ubiquitin Ligase in Complex with An E2- Ub Thioester Intermediate Mimic:
2.3.2.23;
Protein crystallography data
The structure of Crystal Structure of An Rbr E3 Ubiquitin Ligase in Complex with An E2- Ub Thioester Intermediate Mimic, PDB code: 5tte
was solved by
L.Yuan,
Z.Lv,
S.K.Olsen,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
49.71 /
3.50
|
Space group
|
P 65 2 2
|
Cell size a, b, c (Å), α, β, γ (°)
|
154.234,
154.234,
285.501,
90.00,
90.00,
120.00
|
R / Rfree (%)
|
22.6 /
25.2
|
Zinc Binding Sites:
The binding sites of Zinc atom in the Crystal Structure of An Rbr E3 Ubiquitin Ligase in Complex with An E2- Ub Thioester Intermediate Mimic
(pdb code 5tte). This binding sites where shown within
5.0 Angstroms radius around Zinc atom.
In total 6 binding sites of Zinc where determined in the
Crystal Structure of An Rbr E3 Ubiquitin Ligase in Complex with An E2- Ub Thioester Intermediate Mimic, PDB code: 5tte:
Jump to Zinc binding site number:
1;
2;
3;
4;
5;
6;
Zinc binding site 1 out
of 6 in 5tte
Go back to
Zinc Binding Sites List in 5tte
Zinc binding site 1 out
of 6 in the Crystal Structure of An Rbr E3 Ubiquitin Ligase in Complex with An E2- Ub Thioester Intermediate Mimic
Mono view
Stereo pair view
|
A full contact list of Zinc with other atoms in the Zn binding
site number 1 of Crystal Structure of An Rbr E3 Ubiquitin Ligase in Complex with An E2- Ub Thioester Intermediate Mimic within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Zn601
b:0.5
occ:1.00
|
SG
|
B:CYS347
|
2.3
|
96.9
|
1.0
|
SG
|
B:CYS367
|
2.3
|
0.4
|
1.0
|
SG
|
B:CYS362
|
2.3
|
0.8
|
1.0
|
SG
|
B:CYS344
|
2.4
|
0.8
|
1.0
|
CB
|
B:CYS362
|
2.5
|
0.2
|
1.0
|
O
|
B:CYS367
|
3.0
|
94.0
|
1.0
|
CB
|
B:CYS347
|
3.3
|
0.8
|
1.0
|
CB
|
B:CYS367
|
3.4
|
0.3
|
1.0
|
CB
|
B:CYS344
|
3.7
|
0.8
|
1.0
|
N
|
B:CYS347
|
3.8
|
0.8
|
1.0
|
C
|
B:CYS367
|
3.9
|
0.3
|
1.0
|
CA
|
B:CYS362
|
4.1
|
0.7
|
1.0
|
CA
|
B:CYS347
|
4.2
|
0.9
|
1.0
|
CA
|
B:CYS367
|
4.3
|
0.6
|
1.0
|
CB
|
B:ALA369
|
4.3
|
0.6
|
1.0
|
N
|
B:ALA369
|
4.4
|
0.3
|
1.0
|
CB
|
B:LYS346
|
4.6
|
82.5
|
1.0
|
O
|
B:ALA369
|
4.7
|
0.3
|
1.0
|
N
|
B:CYS362
|
4.8
|
91.7
|
1.0
|
C
|
B:LYS346
|
4.8
|
0.7
|
1.0
|
C
|
B:CYS362
|
4.9
|
0.9
|
1.0
|
CA
|
B:ALA369
|
4.9
|
0.5
|
1.0
|
|
Zinc binding site 2 out
of 6 in 5tte
Go back to
Zinc Binding Sites List in 5tte
Zinc binding site 2 out
of 6 in the Crystal Structure of An Rbr E3 Ubiquitin Ligase in Complex with An E2- Ub Thioester Intermediate Mimic
Mono view
Stereo pair view
|
A full contact list of Zinc with other atoms in the Zn binding
site number 2 of Crystal Structure of An Rbr E3 Ubiquitin Ligase in Complex with An E2- Ub Thioester Intermediate Mimic within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Zn602
b:0.5
occ:1.00
|
NE2
|
B:HIS382
|
2.0
|
87.8
|
1.0
|
SG
|
B:CYS375
|
2.4
|
87.0
|
1.0
|
SG
|
B:CYS372
|
2.4
|
0.6
|
1.0
|
SG
|
B:CYS389
|
2.4
|
90.1
|
1.0
|
CD2
|
B:HIS382
|
2.9
|
88.2
|
1.0
|
CE1
|
B:HIS382
|
3.1
|
0.6
|
1.0
|
CB
|
B:CYS389
|
3.1
|
98.2
|
1.0
|
CB
|
B:CYS372
|
3.2
|
0.8
|
1.0
|
CB
|
B:CYS375
|
3.3
|
86.9
|
1.0
|
N
|
B:CYS375
|
3.9
|
0.4
|
1.0
|
CG
|
B:HIS382
|
4.1
|
88.0
|
1.0
|
ND1
|
B:HIS382
|
4.1
|
87.5
|
1.0
|
CA
|
B:CYS375
|
4.2
|
87.2
|
1.0
|
CA
|
B:CYS389
|
4.6
|
87.0
|
1.0
|
CB
|
B:VAL374
|
4.7
|
89.8
|
1.0
|
CA
|
B:CYS372
|
4.7
|
91.9
|
1.0
|
C
|
B:VAL374
|
5.0
|
0.4
|
1.0
|
C
|
B:CYS375
|
5.0
|
86.8
|
1.0
|
|
Zinc binding site 3 out
of 6 in 5tte
Go back to
Zinc Binding Sites List in 5tte
Zinc binding site 3 out
of 6 in the Crystal Structure of An Rbr E3 Ubiquitin Ligase in Complex with An E2- Ub Thioester Intermediate Mimic
Mono view
Stereo pair view
|
A full contact list of Zinc with other atoms in the Zn binding
site number 3 of Crystal Structure of An Rbr E3 Ubiquitin Ligase in Complex with An E2- Ub Thioester Intermediate Mimic within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Zn603
b:0.1
occ:1.00
|
SG
|
B:CYS208
|
2.3
|
80.6
|
1.0
|
SG
|
B:CYS186
|
2.3
|
84.5
|
1.0
|
SG
|
B:CYS189
|
2.3
|
79.9
|
1.0
|
SG
|
B:CYS211
|
2.3
|
77.4
|
1.0
|
CB
|
B:CYS186
|
3.2
|
0.3
|
1.0
|
CB
|
B:CYS208
|
3.2
|
80.3
|
1.0
|
CB
|
B:CYS211
|
3.6
|
75.9
|
1.0
|
CB
|
B:CYS189
|
3.6
|
80.7
|
1.0
|
N
|
B:CYS189
|
3.9
|
0.3
|
1.0
|
N
|
B:CYS208
|
4.1
|
79.3
|
1.0
|
CA
|
B:CYS208
|
4.3
|
78.2
|
1.0
|
CA
|
B:CYS189
|
4.4
|
92.5
|
1.0
|
N
|
B:CYS211
|
4.4
|
92.8
|
1.0
|
CA
|
B:CYS186
|
4.6
|
91.0
|
1.0
|
CA
|
B:CYS211
|
4.6
|
76.3
|
1.0
|
CB
|
B:ILE188
|
4.7
|
75.1
|
1.0
|
O
|
B:CYS208
|
4.8
|
95.9
|
1.0
|
N
|
B:ILE188
|
4.8
|
75.6
|
1.0
|
C
|
B:ILE188
|
4.8
|
0.2
|
1.0
|
C
|
B:CYS208
|
4.9
|
92.6
|
1.0
|
|
Zinc binding site 4 out
of 6 in 5tte
Go back to
Zinc Binding Sites List in 5tte
Zinc binding site 4 out
of 6 in the Crystal Structure of An Rbr E3 Ubiquitin Ligase in Complex with An E2- Ub Thioester Intermediate Mimic
Mono view
Stereo pair view
|
A full contact list of Zinc with other atoms in the Zn binding
site number 4 of Crystal Structure of An Rbr E3 Ubiquitin Ligase in Complex with An E2- Ub Thioester Intermediate Mimic within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Zn604
b:0.4
occ:1.00
|
ND1
|
B:HIS205
|
2.0
|
72.8
|
1.0
|
SG
|
B:CYS231
|
2.1
|
68.8
|
1.0
|
SG
|
B:CYS203
|
2.1
|
69.6
|
1.0
|
SG
|
B:CYS236
|
2.2
|
87.6
|
1.0
|
CB
|
B:CYS231
|
2.8
|
68.2
|
1.0
|
CE1
|
B:HIS205
|
2.9
|
69.1
|
1.0
|
CG
|
B:HIS205
|
3.0
|
99.6
|
1.0
|
CB
|
B:CYS236
|
3.1
|
0.7
|
1.0
|
CB
|
B:HIS205
|
3.4
|
0.6
|
1.0
|
CB
|
B:CYS203
|
3.4
|
77.0
|
1.0
|
NE2
|
B:HIS205
|
4.1
|
85.8
|
1.0
|
CD2
|
B:HIS205
|
4.1
|
97.0
|
1.0
|
CB
|
B:ALA233
|
4.1
|
98.6
|
1.0
|
CG2
|
B:ILE238
|
4.2
|
67.5
|
1.0
|
CA
|
B:CYS231
|
4.2
|
68.4
|
1.0
|
CA
|
B:CYS236
|
4.5
|
68.7
|
1.0
|
C
|
B:CYS231
|
4.6
|
68.9
|
1.0
|
N
|
B:HIS205
|
4.6
|
0.8
|
1.0
|
CA
|
B:HIS205
|
4.6
|
1.0
|
1.0
|
O
|
B:CYS231
|
4.7
|
0.9
|
1.0
|
CA
|
B:CYS203
|
4.8
|
68.5
|
1.0
|
|
Zinc binding site 5 out
of 6 in 5tte
Go back to
Zinc Binding Sites List in 5tte
Zinc binding site 5 out
of 6 in the Crystal Structure of An Rbr E3 Ubiquitin Ligase in Complex with An E2- Ub Thioester Intermediate Mimic
Mono view
Stereo pair view
|
A full contact list of Zinc with other atoms in the Zn binding
site number 5 of Crystal Structure of An Rbr E3 Ubiquitin Ligase in Complex with An E2- Ub Thioester Intermediate Mimic within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Zn605
b:0.9
occ:1.00
|
SG
|
B:CYS281
|
2.3
|
0.1
|
1.0
|
SG
|
B:CYS297
|
2.3
|
98.8
|
1.0
|
SG
|
B:CYS299
|
2.3
|
0.9
|
1.0
|
SG
|
B:CYS276
|
2.4
|
0.0
|
1.0
|
CB
|
B:CYS281
|
3.1
|
0.9
|
1.0
|
CB
|
B:CYS276
|
3.4
|
0.7
|
1.0
|
CB
|
B:ALA278
|
3.6
|
0.6
|
1.0
|
CB
|
B:CYS297
|
3.7
|
98.0
|
1.0
|
O
|
B:CYS297
|
3.7
|
83.8
|
1.0
|
CB
|
B:CYS299
|
4.0
|
0.0
|
1.0
|
C
|
B:CYS297
|
4.5
|
98.7
|
1.0
|
CA
|
B:CYS281
|
4.5
|
0.6
|
1.0
|
N
|
B:CYS299
|
4.6
|
0.7
|
1.0
|
O
|
B:CYS281
|
4.6
|
0.5
|
1.0
|
CA
|
B:CYS297
|
4.7
|
87.4
|
1.0
|
C
|
B:CYS281
|
4.7
|
0.3
|
1.0
|
CB
|
B:HIS283
|
4.8
|
0.2
|
1.0
|
O
|
B:CYS299
|
4.8
|
0.3
|
1.0
|
ND1
|
B:HIS283
|
4.8
|
0.0
|
1.0
|
CA
|
B:CYS299
|
4.8
|
0.8
|
1.0
|
CA
|
B:CYS276
|
4.8
|
0.6
|
1.0
|
CA
|
B:ALA278
|
4.9
|
0.8
|
1.0
|
|
Zinc binding site 6 out
of 6 in 5tte
Go back to
Zinc Binding Sites List in 5tte
Zinc binding site 6 out
of 6 in the Crystal Structure of An Rbr E3 Ubiquitin Ligase in Complex with An E2- Ub Thioester Intermediate Mimic
Mono view
Stereo pair view
|
A full contact list of Zinc with other atoms in the Zn binding
site number 6 of Crystal Structure of An Rbr E3 Ubiquitin Ligase in Complex with An E2- Ub Thioester Intermediate Mimic within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Zn606
b:0.3
occ:1.00
|
NE2
|
B:HIS312
|
2.0
|
0.4
|
1.0
|
CE1
|
B:HIS312
|
2.2
|
0.4
|
1.0
|
SG
|
B:CYS307
|
2.3
|
0.3
|
1.0
|
SG
|
B:CYS304
|
2.3
|
0.8
|
1.0
|
SG
|
B:CYS317
|
2.3
|
0.6
|
1.0
|
CB
|
B:CYS307
|
3.0
|
0.9
|
1.0
|
CB
|
B:CYS304
|
3.0
|
0.2
|
1.0
|
CD2
|
B:HIS312
|
3.4
|
0.5
|
1.0
|
N
|
B:CYS307
|
3.4
|
0.8
|
1.0
|
ND1
|
B:HIS312
|
3.4
|
0.5
|
1.0
|
CB
|
B:CYS317
|
3.5
|
0.0
|
1.0
|
CA
|
B:CYS307
|
3.8
|
0.1
|
1.0
|
CG
|
B:HIS312
|
4.0
|
0.3
|
1.0
|
CA
|
B:CYS317
|
4.1
|
0.9
|
1.0
|
CB
|
B:ASN306
|
4.4
|
0.2
|
1.0
|
CA
|
B:CYS304
|
4.4
|
0.6
|
1.0
|
N
|
B:GLY308
|
4.4
|
0.2
|
1.0
|
C
|
B:ASN306
|
4.5
|
0.1
|
1.0
|
C
|
B:CYS307
|
4.7
|
0.2
|
1.0
|
C
|
B:CYS304
|
4.7
|
0.7
|
1.0
|
O
|
B:CYS304
|
4.8
|
1.0
|
1.0
|
CA
|
B:ASN306
|
4.8
|
0.6
|
1.0
|
N
|
B:ASN306
|
4.8
|
0.2
|
1.0
|
N
|
B:CYS317
|
4.9
|
0.1
|
1.0
|
|
Reference:
L.Yuan,
Z.Lv,
J.H.Atkison,
S.K.Olsen.
Structural Insights Into the Mechanism and E2 Specificity of the Rbr E3 Ubiquitin Ligase Hhari. Nat Commun V. 8 211 2017.
ISSN: ESSN 2041-1723
PubMed: 28790309
DOI: 10.1038/S41467-017-00272-6
Page generated: Mon Oct 28 08:48:19 2024
|