ReDisulphID

a tool for identifying drug-targetable redox-active disulphides

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Alpha-1-acid glycoprotein 1

Intramolecular
Cysteine 23 and cysteine 165
Cysteine 90 and cysteine 183
A redox-regulated disulphide may form within Alpha-1-acid glycoprotein 1 between cysteines 23 and 165 (5 and 147 respectively in this structure).

Details

Redox score ?
87
PDB code
3kq0
Structure name
crystal structure of human alpha1-acid glycoprotein
Structure deposition date
2009-11-17
Thiol separation (Å)
2
Half-sphere exposure sum ?
40
Minimum pKa ?
nan
% buried
nan
Peptide accession
P02763
Residue number A
23
Residue number B
165
Peptide name
Alpha-1-acid glycoprotein 1

Ligandability

Cysteine 23 of Alpha-1-acid glycoprotein 1

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 165 of Alpha-1-acid glycoprotein 1

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 Alpha-1-acid glycoprotein 1 between cysteines 90 and 183 (72 and 165 respectively in this structure).

Details

Redox score ?
86
PDB code
3kq0
Structure name
crystal structure of human alpha1-acid glycoprotein
Structure deposition date
2009-11-17
Thiol separation (Å)
2
Half-sphere exposure sum ?
52
Minimum pKa ?
nan
% buried
nan
Peptide accession
P02763
Residue number A
90
Residue number B
183
Peptide name
Alpha-1-acid glycoprotein 1

Ligandability

Cysteine 90 of Alpha-1-acid glycoprotein 1

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 183 of Alpha-1-acid glycoprotein 1

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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