ReDisulphID

a tool for identifying drug-targetable redox-active disulphides

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HLA class I histocompatibility antigen

Intramolecular
Cysteine 125 and cysteine 188
Cysteine 227 and cysteine 283
A redox-regulated disulphide may form within HLA class I histocompatibility antigen between cysteines 125 and 188 (102 and 165 respectively in this structure).

Details

Redox score ?
82
PDB code
7mja
Structure name
hla-a*24:02 bound to neuroblastoma derived phox2b peptide
Structure deposition date
2021-04-19
Thiol separation (Å)
2
Half-sphere exposure sum ?
82
Minimum pKa ?
nan
% buried
nan
Peptide accession
Q95J06
Residue number A
125
Residue number B
188
Peptide name
HLA class I histocompatibility antigen

Ligandability

Cysteine 125 of HLA class I histocompatibility antigen

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 188 of HLA class I histocompatibility antigen

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 HLA class I histocompatibility antigen between cysteines 227 and 283 (204 and 260 respectively in this structure).

Details

Redox score ?
79
PDB code
7mja
Structure name
hla-a*24:02 bound to neuroblastoma derived phox2b peptide
Structure deposition date
2021-04-19
Thiol separation (Å)
2
Half-sphere exposure sum ?
83
Minimum pKa ?
nan
% buried
nan
Peptide accession
Q95J06
Residue number A
227
Residue number B
283
Peptide name
HLA class I histocompatibility antigen

Ligandability

Cysteine 227 of HLA class I histocompatibility antigen

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 283 of HLA class I histocompatibility antigen

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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