ReDisulphID

a tool for identifying drug-targetable redox-active disulphides

Home
About
List

Calcium/calmodulin-dependent protein kinase type II subunit alpha

Intermolecular
Cysteine 428 and cysteine 428
Intramolecular
Cysteine 64 and cysteine 126
Cysteine 115 and cysteine 199
Cysteine 126 and cysteine 199
A redox-regulated disulphide may form between two units of Calcium/calmodulin-dependent protein kinase type II subunit alpha at cysteines 428 and 428. However, the redox score of this cysteine pair is lower than any known redox-active intermolecular disulphide. ?

Details

Redox score ?
39
PDB code
6of8
Structure name
structure of thr354asn, glu355gln, thr412asn, ile414met, ile464his, and phe467met mutant human camkii-alpha hub domain
Structure deposition date
2019-03-28
Thiol separation (Å)
7
Half-sphere exposure sum ?
97
Minimum pKa ?
13
% buried
100
Peptide A name
Calcium/calmodulin-dependent protein kinase type II subunit alpha
Peptide B name
Calcium/calmodulin-dependent protein kinase type II subunit alpha
Peptide A accession
Q9UQM7
Peptide B accession
Q9UQM7
Peptide A residue number
428
Peptide B residue number
428

Ligandability

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 Calcium/calmodulin-dependent protein kinase type II subunit alpha between cysteines 64 and 126. However, the redox score of this cysteine pair is lower than any known redox-active intermolecular disulphide. ?

Details

Redox score ?
34
PDB code
7ujr
Structure name
cocrystal structure of human camkii-alpha (camk2a)kinase domain and glun2b
Structure deposition date
2022-03-31
Thiol separation (Å)
9
Half-sphere exposure sum ?
81
Minimum pKa ?
12
% buried
96
Peptide accession
Q9UQM7
Residue number A
64
Residue number B
126
Peptide name
Calcium/calmodulin-dependent protein kinase type II subunit alpha

Ligandability

Cysteine 64 of Calcium/calmodulin-dependent protein kinase type II subunit alpha

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 126 of Calcium/calmodulin-dependent protein kinase type II subunit alpha

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 Calcium/calmodulin-dependent protein kinase type II subunit alpha between cysteines 115 and 199. However, the redox score of this cysteine pair is lower than any known redox-active intermolecular disulphide. ?

Details

Redox score ?
23
PDB code
6vzk
Structure name
crystal structure of human camkii-alpha (camk2a)kinase domain
Structure deposition date
2020-02-28
Thiol separation (Å)
10
Half-sphere exposure sum ?
92
Minimum pKa ?
12
% buried
99
Peptide accession
Q9UQM7
Residue number A
115
Residue number B
199
Peptide name
Calcium/calmodulin-dependent protein kinase type II subunit alpha

Ligandability

Cysteine 115 of Calcium/calmodulin-dependent protein kinase type II subunit alpha

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 199 of Calcium/calmodulin-dependent protein kinase type II subunit alpha

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 Calcium/calmodulin-dependent protein kinase type II subunit alpha between cysteines 126 and 199. However, the redox score of this cysteine pair is lower than any known redox-active intermolecular disulphide. ?

Details

Redox score ?
22
PDB code
7ujt
Structure name
cocrystal structure of human camkii-alpha (camk2a)kinase domain and glun2b(s1303d) in complex with atp
Structure deposition date
2022-03-31
Thiol separation (Å)
10
Half-sphere exposure sum ?
94
Minimum pKa ?
13
% buried
99
Peptide accession
Q9UQM7
Residue number A
126
Residue number B
199
Peptide name
Calcium/calmodulin-dependent protein kinase type II subunit alpha

Ligandability

Cysteine 126 of Calcium/calmodulin-dependent protein kinase type II subunit alpha

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 199 of Calcium/calmodulin-dependent protein kinase type II subunit alpha

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.

If this tool was useful for finding a disulphide, please cite: