ReDisulphID

a tool for identifying drug-targetable redox-active disulphides

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PAS domain-containing serine/threonine-protein kinase

Intramolecular
Cysteine 1039 and cysteine 1163
Cysteine 227 and cysteine 228
A redox-regulated disulphide may form within PAS domain-containing serine/threonine-protein kinase between cysteines 1039 and 1163. However, the redox score of this cysteine pair is lower than any known redox-active intermolecular disulphide. ?

Details

Redox score ?
55
PDB code
3dls
Structure name
crystal structure of human pas kinase bound to adp
Structure deposition date
2008-06-29
Thiol separation (Å)
7
Half-sphere exposure sum ?
51
Minimum pKa ?
9
% buried
32
Peptide accession
Q96RG2
Residue number A
1039
Residue number B
1163
Peptide name
PAS domain-containing serine/threonine-protein kinase

Ligandability

Cysteine 1039 of PAS domain-containing serine/threonine-protein kinase

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 1163 of PAS domain-containing serine/threonine-protein kinase

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 PAS domain-containing serine/threonine-protein kinase between cysteines 227 and 228 (104 and 105 respectively in this structure). However, the redox score of this cysteine pair is lower than any known redox-active intermolecular disulphide. ?

Details

Redox score ?
53
PDB code
1ll8
Structure name
structure and interactions of pas kinase n-terminal pas domain: model for intramolecular kinase regulation
Structure deposition date
2002-04-26
Thiol separation (Å)
7
Half-sphere exposure sum ?
58
Minimum pKa ?
10
% buried
28
Peptide accession
Q96RG2
Residue number A
227
Residue number B
228
Peptide name
PAS domain-containing serine/threonine-protein kinase

Ligandability

Cysteine 227 of PAS domain-containing serine/threonine-protein kinase

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 228 of PAS domain-containing serine/threonine-protein kinase

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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