ReDisulphID

a tool for identifying drug-targetable redox-active disulphides

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TRA@ protein

Intramolecular
Cysteine 160 and cysteine 210
Cysteine 43 and cysteine 112
A redox-regulated disulphide may form within TRA@ protein between cysteines 160 and 210 (136 and 186 respectively in this structure).

Details

Redox score ?
80
PDB code
6bj3
Structure name
tcr55 in complex with hiv(pol448-456)/hla-b35
Structure deposition date
2017-11-03
Thiol separation (Å)
2
Half-sphere exposure sum ?
76
Minimum pKa ?
nan
% buried
nan
Peptide accession
Q6IRV4
Residue number A
160
Residue number B
210
Peptide name
TRA@ protein

Ligandability

Cysteine 160 of TRA@ protein

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 210 of TRA@ protein

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 TRA@ protein between cysteines 43 and 112 (23 and 91 respectively in this structure).

Details

Redox score ?
80
PDB code
6bj8
Structure name
tcr55 in complex with pep20/hla-b35
Structure deposition date
2017-11-05
Thiol separation (Å)
2
Half-sphere exposure sum ?
85
Minimum pKa ?
nan
% buried
nan
Peptide accession
Q6IRV4
Residue number A
43
Residue number B
112
Peptide name
TRA@ protein

Ligandability

Cysteine 43 of TRA@ protein

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 112 of TRA@ protein

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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