ReDisulphID

a tool for identifying drug-targetable redox-active disulphides

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Tuberin

Intramolecular
Cysteine 738 and cysteine 791
Cysteine 230 and cysteine 244
Cysteine 227 and cysteine 256
Cysteine 203 and cysteine 206
Cysteine 734 and cysteine 738
Cysteine 734 and cysteine 791
Cysteine 800 and cysteine 804
Cysteine 227 and cysteine 230
Cysteine 728 and cysteine 734
Cysteine 804 and cysteine 811
More...
Cysteine 791 and cysteine 804
Cysteine 206 and cysteine 230
A redox-regulated disulphide may form within Tuberin between cysteines 738 and 791.

Details

Redox score ?
78
PDB code
7dl2
Structure name
cryo-em structure of human tsc complex
Structure deposition date
2020-11-25
Thiol separation (Å)
4
Half-sphere exposure sum ?
69
Minimum pKa ?
4
% buried
69
Peptide accession
P49815
Residue number A
738
Residue number B
791
Peptide name
Tuberin

Ligandability

Cysteine 738 of Tuberin

Not ligandable in the dataset of Yang et al.

Not ligandable in the dataset of Yan et al.

Not ligandable in the dataset of Backus et al.

Not ligandable in the dataset of Vinogradova et al.

Not ligandable in the dataset of Cao et al.

Not ligandable in the dataset of Kuljanin et al.

Cysteine 791 of Tuberin

Not ligandable in the dataset of Yang et al.

Not ligandable in the dataset of Yan et al.

Not ligandable in the dataset of Backus et al.

Not ligandable in the dataset of Vinogradova et al.

Not ligandable in the dataset of Cao et al.

Not ligandable in the dataset of Kuljanin et al.

A redox-regulated disulphide may form within Tuberin between cysteines 230 and 244.

Details

Redox score ?
74
PDB code
7dl2
Structure name
cryo-em structure of human tsc complex
Structure deposition date
2020-11-25
Thiol separation (Å)
5
Half-sphere exposure sum ?
73
Minimum pKa ?
5
% buried
83
Peptide accession
P49815
Residue number A
230
Residue number B
244
Peptide name
Tuberin

Ligandability

Cysteine 230 of Tuberin

Not ligandable in the dataset of Yang et al.

Not ligandable in the dataset of Yan et al.

Not ligandable in the dataset of Backus et al.

Not ligandable in the dataset of Vinogradova et al.

Not ligandable in the dataset of Cao et al.

Not ligandable in the dataset of Kuljanin et al.

Cysteine 244 of Tuberin

Not ligandable in the dataset of Yang et al.

Not ligandable in the dataset of Yan et al.

Not ligandable in the dataset of Backus et al.

Not ligandable in the dataset of Vinogradova et al.

Not ligandable in the dataset of Cao et al.

Not ligandable in the dataset of Kuljanin et al.

A redox-regulated disulphide may form within Tuberin between cysteines 227 and 256.

Details

Redox score ?
64
PDB code
7dl2
Structure name
cryo-em structure of human tsc complex
Structure deposition date
2020-11-25
Thiol separation (Å)
5
Half-sphere exposure sum ?
59
Minimum pKa ?
10
% buried
34
Peptide accession
P49815
Residue number A
227
Residue number B
256
Peptide name
Tuberin

Ligandability

Cysteine 227 of Tuberin

Not ligandable in the dataset of Yang et al.

Not ligandable in the dataset of Yan et al.

Not ligandable in the dataset of Backus et al.

Not ligandable in the dataset of Vinogradova et al.

Not ligandable in the dataset of Cao et al.

Not ligandable in the dataset of Kuljanin et al.

Cysteine 256 of Tuberin

Not ligandable in the dataset of Yang et al.

Not ligandable in the dataset of Yan et al.

Not ligandable in the dataset of Backus et al.

Not ligandable in the dataset of Vinogradova et al.

Not ligandable in the dataset of Cao et al.

Not ligandable in the dataset of Kuljanin et al.

A redox-regulated disulphide may form within Tuberin between cysteines 203 and 206.

Details

Redox score ?
64
PDB code
7dl2
Structure name
cryo-em structure of human tsc complex
Structure deposition date
2020-11-25
Thiol separation (Å)
6
Half-sphere exposure sum ?
57
Minimum pKa ?
9
% buried
38
Peptide accession
P49815
Residue number A
203
Residue number B
206
Peptide name
Tuberin

Ligandability

Cysteine 203 of Tuberin

Not ligandable in the dataset of Yang et al.

Not ligandable in the dataset of Yan et al.

Not ligandable in the dataset of Backus et al.

Not ligandable in the dataset of Vinogradova et al.

Not ligandable in the dataset of Cao et al.

Not ligandable in the dataset of Kuljanin et al.

Cysteine 206 of Tuberin

Not ligandable in the dataset of Yang et al.

Not ligandable in the dataset of Yan et al.

Not ligandable in the dataset of Backus et al.

Not ligandable in the dataset of Vinogradova et al.

Not ligandable in the dataset of Cao et al.

Not ligandable in the dataset of Kuljanin et al.

A redox-regulated disulphide may form within Tuberin between cysteines 734 and 738. However, the redox score of this cysteine pair is lower than any known redox-active intermolecular disulphide. ?

Details

Redox score ?
58
PDB code
7dl2
Structure name
cryo-em structure of human tsc complex
Structure deposition date
2020-11-25
Thiol separation (Å)
6
Half-sphere exposure sum ?
68
Minimum pKa ?
9
% buried
54
Peptide accession
P49815
Residue number A
734
Residue number B
738
Peptide name
Tuberin

Ligandability

Cysteine 734 of Tuberin

Not ligandable in the dataset of Yang et al.

Not ligandable in the dataset of Yan et al.

Not ligandable in the dataset of Backus et al.

Not ligandable in the dataset of Vinogradova et al.

Not ligandable in the dataset of Cao et al.

Not ligandable in the dataset of Kuljanin et al.

Cysteine 738 of Tuberin

Not ligandable in the dataset of Yang et al.

Not ligandable in the dataset of Yan et al.

Not ligandable in the dataset of Backus et al.

Not ligandable in the dataset of Vinogradova et al.

Not ligandable in the dataset of Cao et al.

Not ligandable in the dataset of Kuljanin et al.

A redox-regulated disulphide may form within Tuberin between cysteines 734 and 791. However, the redox score of this cysteine pair is lower than any known redox-active intermolecular disulphide. ?

Details

Redox score ?
46
PDB code
7dl2
Structure name
cryo-em structure of human tsc complex
Structure deposition date
2020-11-25
Thiol separation (Å)
7
Half-sphere exposure sum ?
69
Minimum pKa ?
11
% buried
64
Peptide accession
P49815
Residue number A
734
Residue number B
791
Peptide name
Tuberin

Ligandability

Cysteine 734 of Tuberin

Not ligandable in the dataset of Yang et al.

Not ligandable in the dataset of Yan et al.

Not ligandable in the dataset of Backus et al.

Not ligandable in the dataset of Vinogradova et al.

Not ligandable in the dataset of Cao et al.

Not ligandable in the dataset of Kuljanin et al.

Cysteine 791 of Tuberin

Not ligandable in the dataset of Yang et al.

Not ligandable in the dataset of Yan et al.

Not ligandable in the dataset of Backus et al.

Not ligandable in the dataset of Vinogradova et al.

Not ligandable in the dataset of Cao et al.

Not ligandable in the dataset of Kuljanin et al.

A redox-regulated disulphide may form within Tuberin between cysteines 800 and 804. However, the redox score of this cysteine pair is lower than any known redox-active intermolecular disulphide. ?

Details

Redox score ?
46
PDB code
7dl2
Structure name
cryo-em structure of human tsc complex
Structure deposition date
2020-11-25
Thiol separation (Å)
9
Half-sphere exposure sum ?
64
Minimum pKa ?
8
% buried
61
Peptide accession
P49815
Residue number A
800
Residue number B
804
Peptide name
Tuberin

Ligandability

Cysteine 800 of Tuberin

Not ligandable in the dataset of Yang et al.

Not ligandable in the dataset of Yan et al.

Not ligandable in the dataset of Backus et al.

Not ligandable in the dataset of Vinogradova et al.

Not ligandable in the dataset of Cao et al.

Not ligandable in the dataset of Kuljanin et al.

Cysteine 804 of Tuberin

Not ligandable in the dataset of Yang et al.

Not ligandable in the dataset of Yan et al.

Not ligandable in the dataset of Backus et al.

Not ligandable in the dataset of Vinogradova et al.

Not ligandable in the dataset of Cao et al.

Not ligandable in the dataset of Kuljanin et al.

A redox-regulated disulphide may form within Tuberin between cysteines 227 and 230. However, the redox score of this cysteine pair is lower than any known redox-active intermolecular disulphide. ?

Details

Redox score ?
41
PDB code
7dl2
Structure name
cryo-em structure of human tsc complex
Structure deposition date
2020-11-25
Thiol separation (Å)
8
Half-sphere exposure sum ?
76
Minimum pKa ?
11
% buried
68
Peptide accession
P49815
Residue number A
227
Residue number B
230
Peptide name
Tuberin

Ligandability

Cysteine 227 of Tuberin

Not ligandable in the dataset of Yang et al.

Not ligandable in the dataset of Yan et al.

Not ligandable in the dataset of Backus et al.

Not ligandable in the dataset of Vinogradova et al.

Not ligandable in the dataset of Cao et al.

Not ligandable in the dataset of Kuljanin et al.

Cysteine 230 of Tuberin

Not ligandable in the dataset of Yang et al.

Not ligandable in the dataset of Yan et al.

Not ligandable in the dataset of Backus et al.

Not ligandable in the dataset of Vinogradova et al.

Not ligandable in the dataset of Cao et al.

Not ligandable in the dataset of Kuljanin et al.

A redox-regulated disulphide may form within Tuberin between cysteines 728 and 734. However, the redox score of this cysteine pair is lower than any known redox-active intermolecular disulphide. ?

Details

Redox score ?
39
PDB code
7dl2
Structure name
cryo-em structure of human tsc complex
Structure deposition date
2020-11-25
Thiol separation (Å)
10
Half-sphere exposure sum ?
56
Minimum pKa ?
10
% buried
43
Peptide accession
P49815
Residue number A
728
Residue number B
734
Peptide name
Tuberin

Ligandability

Cysteine 728 of Tuberin

Not ligandable in the dataset of Yang et al.

Not ligandable in the dataset of Yan et al.

Not ligandable in the dataset of Backus et al.

Not ligandable in the dataset of Vinogradova et al.

Not ligandable in the dataset of Cao et al.

Not ligandable in the dataset of Kuljanin et al.

Cysteine 734 of Tuberin

Not ligandable in the dataset of Yang et al.

Not ligandable in the dataset of Yan et al.

Not ligandable in the dataset of Backus et al.

Not ligandable in the dataset of Vinogradova et al.

Not ligandable in the dataset of Cao et al.

Not ligandable in the dataset of Kuljanin et al.

A redox-regulated disulphide may form within Tuberin between cysteines 804 and 811. However, the redox score of this cysteine pair is lower than any known redox-active intermolecular disulphide. ?

Details

Redox score ?
37
PDB code
7dl2
Structure name
cryo-em structure of human tsc complex
Structure deposition date
2020-11-25
Thiol separation (Å)
8
Half-sphere exposure sum ?
79
Minimum pKa ?
12
% buried
96
Peptide accession
P49815
Residue number A
804
Residue number B
811
Peptide name
Tuberin

Ligandability

Cysteine 804 of Tuberin

Not ligandable in the dataset of Yang et al.

Not ligandable in the dataset of Yan et al.

Not ligandable in the dataset of Backus et al.

Not ligandable in the dataset of Vinogradova et al.

Not ligandable in the dataset of Cao et al.

Not ligandable in the dataset of Kuljanin et al.

Cysteine 811 of Tuberin

Not ligandable in the dataset of Yang et al.

Not ligandable in the dataset of Yan et al.

Not ligandable in the dataset of Backus et al.

Not ligandable in the dataset of Vinogradova et al.

Not ligandable in the dataset of Cao et al.

Not ligandable in the dataset of Kuljanin et al.

A redox-regulated disulphide may form within Tuberin between cysteines 791 and 804. However, the redox score of this cysteine pair is lower than any known redox-active intermolecular disulphide. ?

Details

Redox score ?
34
PDB code
7dl2
Structure name
cryo-em structure of human tsc complex
Structure deposition date
2020-11-25
Thiol separation (Å)
9
Half-sphere exposure sum ?
72
Minimum pKa ?
11
% buried
73
Peptide accession
P49815
Residue number A
791
Residue number B
804
Peptide name
Tuberin

Ligandability

Cysteine 791 of Tuberin

Not ligandable in the dataset of Yang et al.

Not ligandable in the dataset of Yan et al.

Not ligandable in the dataset of Backus et al.

Not ligandable in the dataset of Vinogradova et al.

Not ligandable in the dataset of Cao et al.

Not ligandable in the dataset of Kuljanin et al.

Cysteine 804 of Tuberin

Not ligandable in the dataset of Yang et al.

Not ligandable in the dataset of Yan et al.

Not ligandable in the dataset of Backus et al.

Not ligandable in the dataset of Vinogradova et al.

Not ligandable in the dataset of Cao et al.

Not ligandable in the dataset of Kuljanin et al.

A redox-regulated disulphide may form within Tuberin between cysteines 206 and 230. However, the redox score of this cysteine pair is lower than any known redox-active intermolecular disulphide. ?

Details

Redox score ?
31
PDB code
7dl2
Structure name
cryo-em structure of human tsc complex
Structure deposition date
2020-11-25
Thiol separation (Å)
10
Half-sphere exposure sum ?
67
Minimum pKa ?
11
% buried
73
Peptide accession
P49815
Residue number A
206
Residue number B
230
Peptide name
Tuberin

Ligandability

Cysteine 206 of Tuberin

Not ligandable in the dataset of Yang et al.

Not ligandable in the dataset of Yan et al.

Not ligandable in the dataset of Backus et al.

Not ligandable in the dataset of Vinogradova et al.

Not ligandable in the dataset of Cao et al.

Not ligandable in the dataset of Kuljanin et al.

Cysteine 230 of Tuberin

Not ligandable in the dataset of Yang et al.

Not ligandable in the dataset of Yan et al.

Not ligandable in the dataset of Backus et al.

Not ligandable in the dataset of Vinogradova et al.

Not ligandable in the dataset of Cao et al.

Not ligandable in the dataset of Kuljanin et al.

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