ReDisulphID

a tool for identifying drug-targetable redox-active disulphides

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Histocompatibility 2, T region locus 22

Intramolecular
Cysteine 135 and cysteine 158
Cysteine 126 and cysteine 176
Cysteine 215 and cysteine 271
Cysteine 126 and cysteine 135
Cysteine 126 and cysteine 158
Cysteine 135 and cysteine 176
Cysteine 158 and cysteine 176
A redox-regulated disulphide may form within Histocompatibility 2, T region locus 22 between cysteines 135 and 158 (110 and 133 respectively in this structure).

Details

Redox score ?
85
PDB code
1c16
Structure name
crystal structure analysis of the gamma/delta t cell ligand t22
Structure deposition date
1999-07-20
Thiol separation (Å)
2
Half-sphere exposure sum ?
59
Minimum pKa ?
nan
% buried
nan
Peptide accession
Q31615
Residue number A
135
Residue number B
158
Peptide name
Histocompatibility 2, T region locus 22

Ligandability

Cysteine 135 of Histocompatibility 2, T region locus 22

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 158 of Histocompatibility 2, T region locus 22

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 Histocompatibility 2, T region locus 22 between cysteines 126 and 176 (101 and 164 respectively in this structure).

Details

Redox score ?
81
PDB code
1c16
Structure name
crystal structure analysis of the gamma/delta t cell ligand t22
Structure deposition date
1999-07-20
Thiol separation (Å)
2
Half-sphere exposure sum ?
78
Minimum pKa ?
nan
% buried
nan
Peptide accession
Q31615
Residue number A
126
Residue number B
176
Peptide name
Histocompatibility 2, T region locus 22

Ligandability

Cysteine 126 of Histocompatibility 2, T region locus 22

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 176 of Histocompatibility 2, T region locus 22

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 Histocompatibility 2, T region locus 22 between cysteines 215 and 271 (203 and 259 respectively in this structure).

Details

Redox score ?
80
PDB code
1c16
Structure name
crystal structure analysis of the gamma/delta t cell ligand t22
Structure deposition date
1999-07-20
Thiol separation (Å)
2
Half-sphere exposure sum ?
83
Minimum pKa ?
nan
% buried
nan
Peptide accession
Q31615
Residue number A
215
Residue number B
271
Peptide name
Histocompatibility 2, T region locus 22

Ligandability

Cysteine 215 of Histocompatibility 2, T region locus 22

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 271 of Histocompatibility 2, T region locus 22

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 Histocompatibility 2, T region locus 22 between cysteines 126 and 135 (101 and 110 respectively in this structure).

Details

Redox score ?
67
PDB code
1c16
Structure name
crystal structure analysis of the gamma/delta t cell ligand t22
Structure deposition date
1999-07-20
Thiol separation (Å)
5
Half-sphere exposure sum ?
68
Minimum pKa ?
nan
% buried
nan
Peptide accession
Q31615
Residue number A
126
Residue number B
135
Peptide name
Histocompatibility 2, T region locus 22

Ligandability

Cysteine 126 of Histocompatibility 2, T region locus 22

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 135 of Histocompatibility 2, T region locus 22

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 Histocompatibility 2, T region locus 22 between cysteines 126 and 158 (101 and 133 respectively in this structure).

Details

Redox score ?
63
PDB code
1c16
Structure name
crystal structure analysis of the gamma/delta t cell ligand t22
Structure deposition date
1999-07-20
Thiol separation (Å)
5
Half-sphere exposure sum ?
66
Minimum pKa ?
nan
% buried
nan
Peptide accession
Q31615
Residue number A
126
Residue number B
158
Peptide name
Histocompatibility 2, T region locus 22

Ligandability

Cysteine 126 of Histocompatibility 2, T region locus 22

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 158 of Histocompatibility 2, T region locus 22

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 Histocompatibility 2, T region locus 22 between cysteines 135 and 176 (110 and 164 respectively in this structure). However, the redox score of this cysteine pair is lower than any known redox-active intermolecular disulphide. ?

Details

Redox score ?
59
PDB code
1c16
Structure name
crystal structure analysis of the gamma/delta t cell ligand t22
Structure deposition date
1999-07-20
Thiol separation (Å)
6
Half-sphere exposure sum ?
70
Minimum pKa ?
nan
% buried
nan
Peptide accession
Q31615
Residue number A
135
Residue number B
176
Peptide name
Histocompatibility 2, T region locus 22

Ligandability

Cysteine 135 of Histocompatibility 2, T region locus 22

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 176 of Histocompatibility 2, T region locus 22

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 Histocompatibility 2, T region locus 22 between cysteines 158 and 176 (133 and 164 respectively in this structure). However, the redox score of this cysteine pair is lower than any known redox-active intermolecular disulphide. ?

Details

Redox score ?
58
PDB code
1c16
Structure name
crystal structure analysis of the gamma/delta t cell ligand t22
Structure deposition date
1999-07-20
Thiol separation (Å)
6
Half-sphere exposure sum ?
64
Minimum pKa ?
nan
% buried
nan
Peptide accession
Q31615
Residue number A
158
Residue number B
176
Peptide name
Histocompatibility 2, T region locus 22

Ligandability

Cysteine 158 of Histocompatibility 2, T region locus 22

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 176 of Histocompatibility 2, T region locus 22

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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