ReDisulphID

a tool for identifying drug-targetable redox-active disulphides

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TGF-beta-activated kinase 1 and MAP3K7-binding protein 2

Intramolecular
Cysteine 670 and cysteine 684
Cysteine 673 and cysteine 684
Cysteine 684 and cysteine 687
Cysteine 670 and cysteine 687
Cysteine 670 and cysteine 673
Cysteine 673 and cysteine 687
A redox-regulated disulphide may form within TGF-beta-activated kinase 1 and MAP3K7-binding protein 2 between cysteines 670 and 684.

Details

Redox score ?
95
PDB code
2wwz
Structure name
tab2 nzf domain in complex with lys63-linked di-ubiquitin, p212121
Structure deposition date
2009-10-30
Thiol separation (Å)
4
Half-sphere exposure sum ?
68
Minimum pKa ?
0
% buried
54
Peptide accession
Q9NYJ8
Residue number A
670
Residue number B
684
Peptide name
TGF-beta-activated kinase 1 and MAP3K7-binding protein 2

Ligandability

Cysteine 670 of TGF-beta-activated kinase 1 and MAP3K7-binding protein 2

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 684 of TGF-beta-activated kinase 1 and MAP3K7-binding protein 2

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 TGF-beta-activated kinase 1 and MAP3K7-binding protein 2 between cysteines 673 and 684.

Details

Redox score ?
87
PDB code
2wx0
Structure name
tab2 nzf domain in complex with lys63-linked di-ubiquitin, p21
Structure deposition date
2009-10-30
Thiol separation (Å)
3
Half-sphere exposure sum ?
70
Minimum pKa ?
3
% buried
58
Peptide accession
Q9NYJ8
Residue number A
673
Residue number B
684
Peptide name
TGF-beta-activated kinase 1 and MAP3K7-binding protein 2

Ligandability

Cysteine 673 of TGF-beta-activated kinase 1 and MAP3K7-binding protein 2

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 684 of TGF-beta-activated kinase 1 and MAP3K7-binding protein 2

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 TGF-beta-activated kinase 1 and MAP3K7-binding protein 2 between cysteines 684 and 687.

Details

Redox score ?
87
PDB code
3a9j
Structure name
crystal structure of the mouse tab2-nzf in complex with lys63-linked di-ubiquitin
Structure deposition date
2009-10-29
Thiol separation (Å)
4
Half-sphere exposure sum ?
63
Minimum pKa ?
3
% buried
48
Peptide accession
Q99K90
Residue number A
684
Residue number B
687
Peptide name
TGF-beta-activated kinase 1 and MAP3K7-binding protein 2

Ligandability

Cysteine 684 of TGF-beta-activated kinase 1 and MAP3K7-binding protein 2

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 687 of TGF-beta-activated kinase 1 and MAP3K7-binding protein 2

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 TGF-beta-activated kinase 1 and MAP3K7-binding protein 2 between cysteines 670 and 687.

Details

Redox score ?
81
PDB code
7e62
Structure name
mouse tab2 nzf in complex with lys6-linked diubiquitin
Structure deposition date
2021-02-21
Thiol separation (Å)
4
Half-sphere exposure sum ?
70
Minimum pKa ?
6
% buried
74
Peptide accession
Q99K90
Residue number A
670
Residue number B
687
Peptide name
TGF-beta-activated kinase 1 and MAP3K7-binding protein 2

Ligandability

Cysteine 670 of TGF-beta-activated kinase 1 and MAP3K7-binding protein 2

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 687 of TGF-beta-activated kinase 1 and MAP3K7-binding protein 2

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 TGF-beta-activated kinase 1 and MAP3K7-binding protein 2 between cysteines 670 and 673.

Details

Redox score ?
78
PDB code
2wx0
Structure name
tab2 nzf domain in complex with lys63-linked di-ubiquitin, p21
Structure deposition date
2009-10-30
Thiol separation (Å)
4
Half-sphere exposure sum ?
70
Minimum pKa ?
8
% buried
48
Peptide accession
Q9NYJ8
Residue number A
670
Residue number B
673
Peptide name
TGF-beta-activated kinase 1 and MAP3K7-binding protein 2

Ligandability

Cysteine 670 of TGF-beta-activated kinase 1 and MAP3K7-binding protein 2

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 673 of TGF-beta-activated kinase 1 and MAP3K7-binding protein 2

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 TGF-beta-activated kinase 1 and MAP3K7-binding protein 2 between cysteines 673 and 687.

Details

Redox score ?
69
PDB code
3a9j
Structure name
crystal structure of the mouse tab2-nzf in complex with lys63-linked di-ubiquitin
Structure deposition date
2009-10-29
Thiol separation (Å)
4
Half-sphere exposure sum ?
68
Minimum pKa ?
11
% buried
48
Peptide accession
Q99K90
Residue number A
673
Residue number B
687
Peptide name
TGF-beta-activated kinase 1 and MAP3K7-binding protein 2

Ligandability

Cysteine 673 of TGF-beta-activated kinase 1 and MAP3K7-binding protein 2

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 687 of TGF-beta-activated kinase 1 and MAP3K7-binding protein 2

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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