ReDisulphID

a tool for identifying drug-targetable redox-active disulphides

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Toll-like receptor 3

Intramolecular
Cysteine 28 and cysteine 37
Cysteine 649 and cysteine 677
Cysteine 95 and cysteine 122
Cysteine 651 and cysteine 696
Cysteine 649 and cysteine 651
A redox-regulated disulphide may form within Toll-like receptor 3 between cysteines 28 and 37.

Details

Redox score ?
86
PDB code
2a0z
Structure name
the molecular structure of toll-like receptor 3 ligand binding domain
Structure deposition date
2005-06-17
Thiol separation (Å)
2
Half-sphere exposure sum ?
55
Minimum pKa ?
nan
% buried
nan
Peptide accession
O15455
Residue number A
28
Residue number B
37
Peptide name
Toll-like receptor 3

Ligandability

Cysteine 28 of Toll-like receptor 3

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 37 of Toll-like receptor 3

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 Toll-like receptor 3 between cysteines 649 and 677.

Details

Redox score ?
83
PDB code
3ulv
Structure name
structure of quaternary complex of human tlr3ecd with three fabs (form2)
Structure deposition date
2011-11-11
Thiol separation (Å)
2
Half-sphere exposure sum ?
70
Minimum pKa ?
nan
% buried
nan
Peptide accession
O15455
Residue number A
649
Residue number B
677
Peptide name
Toll-like receptor 3

Ligandability

Cysteine 649 of Toll-like receptor 3

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 677 of Toll-like receptor 3

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 Toll-like receptor 3 between cysteines 95 and 122.

Details

Redox score ?
83
PDB code
2a0z
Structure name
the molecular structure of toll-like receptor 3 ligand binding domain
Structure deposition date
2005-06-17
Thiol separation (Å)
2
Half-sphere exposure sum ?
71
Minimum pKa ?
nan
% buried
nan
Peptide accession
O15455
Residue number A
95
Residue number B
122
Peptide name
Toll-like receptor 3

Ligandability

Cysteine 95 of Toll-like receptor 3

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 122 of Toll-like receptor 3

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 Toll-like receptor 3 between cysteines 651 and 696.

Details

Redox score ?
76
PDB code
7wv3
Structure name
toll-like receptor3 linear cluster
Structure deposition date
2022-02-09
Thiol separation (Å)
5
Half-sphere exposure sum ?
nan
Minimum pKa ?
9
% buried
4
Peptide accession
O15455
Residue number A
651
Residue number B
696
Peptide name
Toll-like receptor 3

Ligandability

Cysteine 651 of Toll-like receptor 3

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 696 of Toll-like receptor 3

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 Toll-like receptor 3 between cysteines 649 and 651. However, the redox score of this cysteine pair is lower than any known redox-active intermolecular disulphide. ?

Details

Redox score ?
39
PDB code
5gs0
Structure name
crystal structure of the complex of tlr3 and bi-specific diabody
Structure deposition date
2016-08-13
Thiol separation (Å)
10
Half-sphere exposure sum ?
55
Minimum pKa ?
9
% buried
nan
Peptide accession
O15455
Residue number A
649
Residue number B
651
Peptide name
Toll-like receptor 3

Ligandability

Cysteine 649 of Toll-like receptor 3

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 651 of Toll-like receptor 3

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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