ReDisulphID

a tool for identifying drug-targetable redox-active disulphides

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Scinderin

Intramolecular
Cysteine 165 and cysteine 182
Cysteine 165 and cysteine 178
Cysteine 178 and cysteine 182
A redox-regulated disulphide may form within Scinderin between cysteines 165 and 182.

Details

Redox score ?
75
PDB code
5a1k
Structure name
crystal structure of calcium-free human adseverin domains a1-a3
Structure deposition date
2015-04-30
Thiol separation (Å)
4
Half-sphere exposure sum ?
71
Minimum pKa ?
11
% buried
54
Peptide accession
Q9Y6U3
Residue number A
165
Residue number B
182
Peptide name
Scinderin

Ligandability

Cysteine 165 of Scinderin

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 182 of Scinderin

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 Scinderin between cysteines 165 and 178.

Details

Redox score ?
73
PDB code
5a1k
Structure name
crystal structure of calcium-free human adseverin domains a1-a3
Structure deposition date
2015-04-30
Thiol separation (Å)
4
Half-sphere exposure sum ?
82
Minimum pKa ?
7
% buried
57
Peptide accession
Q9Y6U3
Residue number A
165
Residue number B
178
Peptide name
Scinderin

Ligandability

Cysteine 165 of Scinderin

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 178 of Scinderin

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 Scinderin between cysteines 178 and 182.

Details

Redox score ?
69
PDB code
5a1k
Structure name
crystal structure of calcium-free human adseverin domains a1-a3
Structure deposition date
2015-04-30
Thiol separation (Å)
6
Half-sphere exposure sum ?
65
Minimum pKa ?
7
% buried
46
Peptide accession
Q9Y6U3
Residue number A
178
Residue number B
182
Peptide name
Scinderin

Ligandability

Cysteine 178 of Scinderin

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 182 of Scinderin

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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