ReDisulphID

a tool for identifying drug-targetable redox-active disulphides

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Volume-regulated anion channel subunit LRRC8C

Intramolecular
Cysteine 115 and cysteine 293
Cysteine 54 and cysteine 308
Cysteine 293 and cysteine 308
Cysteine 115 and cysteine 308
Cysteine 54 and cysteine 115
Cysteine 54 and cysteine 293
Cysteine 322 and cysteine 325
Cysteine 141 and cysteine 334
Cysteine 473 and cysteine 477
Cysteine 571 and cysteine 599
A redox-regulated disulphide may form within Volume-regulated anion channel subunit LRRC8C between cysteines 115 and 293.

Details

Redox score ?
85
PDB code
8b41
Structure name
structure of heteromeric lrrc8a/c (1:1 co-transfected) volume- regulated anion channel in complex with synthetic nanobody sb1
Structure deposition date
2022-09-19
Thiol separation (Å)
2
Half-sphere exposure sum ?
66
Minimum pKa ?
nan
% buried
nan
Peptide accession
Q8R502
Residue number A
115
Residue number B
293
Peptide name
Volume-regulated anion channel subunit LRRC8C

Ligandability

Cysteine 115 of Volume-regulated anion channel subunit LRRC8C

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 293 of Volume-regulated anion channel subunit LRRC8C

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 Volume-regulated anion channel subunit LRRC8C between cysteines 54 and 308.

Details

Redox score ?
84
PDB code
8b40
Structure name
structure of homomeric lrrc8c volume-regulated anion channel
Structure deposition date
2022-09-19
Thiol separation (Å)
2
Half-sphere exposure sum ?
82
Minimum pKa ?
nan
% buried
nan
Peptide accession
Q8R502
Residue number A
54
Residue number B
308
Peptide name
Volume-regulated anion channel subunit LRRC8C

Ligandability

Cysteine 54 of Volume-regulated anion channel subunit LRRC8C

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 308 of Volume-regulated anion channel subunit LRRC8C

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 Volume-regulated anion channel subunit LRRC8C between cysteines 293 and 308.

Details

Redox score ?
76
PDB code
8b40
Structure name
structure of homomeric lrrc8c volume-regulated anion channel
Structure deposition date
2022-09-19
Thiol separation (Å)
3
Half-sphere exposure sum ?
71
Minimum pKa ?
nan
% buried
nan
Peptide accession
Q8R502
Residue number A
293
Residue number B
308
Peptide name
Volume-regulated anion channel subunit LRRC8C

Ligandability

Cysteine 293 of Volume-regulated anion channel subunit LRRC8C

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 308 of Volume-regulated anion channel subunit LRRC8C

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 Volume-regulated anion channel subunit LRRC8C between cysteines 115 and 308.

Details

Redox score ?
75
PDB code
8b42
Structure name
structure of heteromeric lrrc8a/c volume-regulated anion channel
Structure deposition date
2022-09-19
Thiol separation (Å)
3
Half-sphere exposure sum ?
72
Minimum pKa ?
nan
% buried
nan
Peptide accession
Q8R502
Residue number A
115
Residue number B
308
Peptide name
Volume-regulated anion channel subunit LRRC8C

Ligandability

Cysteine 115 of Volume-regulated anion channel subunit LRRC8C

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 308 of Volume-regulated anion channel subunit LRRC8C

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 Volume-regulated anion channel subunit LRRC8C between cysteines 54 and 115.

Details

Redox score ?
72
PDB code
8b40
Structure name
structure of homomeric lrrc8c volume-regulated anion channel
Structure deposition date
2022-09-19
Thiol separation (Å)
4
Half-sphere exposure sum ?
78
Minimum pKa ?
nan
% buried
nan
Peptide accession
Q8R502
Residue number A
54
Residue number B
115
Peptide name
Volume-regulated anion channel subunit LRRC8C

Ligandability

Cysteine 54 of Volume-regulated anion channel subunit LRRC8C

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 115 of Volume-regulated anion channel subunit LRRC8C

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 Volume-regulated anion channel subunit LRRC8C between cysteines 54 and 293.

Details

Redox score ?
69
PDB code
8b40
Structure name
structure of homomeric lrrc8c volume-regulated anion channel
Structure deposition date
2022-09-19
Thiol separation (Å)
5
Half-sphere exposure sum ?
75
Minimum pKa ?
nan
% buried
nan
Peptide accession
Q8R502
Residue number A
54
Residue number B
293
Peptide name
Volume-regulated anion channel subunit LRRC8C

Ligandability

Cysteine 54 of Volume-regulated anion channel subunit LRRC8C

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 293 of Volume-regulated anion channel subunit LRRC8C

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 Volume-regulated anion channel subunit LRRC8C between cysteines 322 and 325. However, the redox score of this cysteine pair is lower than any known redox-active intermolecular disulphide. ?

Details

Redox score ?
57
PDB code
8b42
Structure name
structure of heteromeric lrrc8a/c volume-regulated anion channel
Structure deposition date
2022-09-19
Thiol separation (Å)
6
Half-sphere exposure sum ?
44
Minimum pKa ?
9
% buried
22
Peptide accession
Q8R502
Residue number A
322
Residue number B
325
Peptide name
Volume-regulated anion channel subunit LRRC8C

Ligandability

Cysteine 322 of Volume-regulated anion channel subunit LRRC8C

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 325 of Volume-regulated anion channel subunit LRRC8C

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 Volume-regulated anion channel subunit LRRC8C between cysteines 141 and 334. However, the redox score of this cysteine pair is lower than any known redox-active intermolecular disulphide. ?

Details

Redox score ?
47
PDB code
8b41
Structure name
structure of heteromeric lrrc8a/c (1:1 co-transfected) volume- regulated anion channel in complex with synthetic nanobody sb1
Structure deposition date
2022-09-19
Thiol separation (Å)
7
Half-sphere exposure sum ?
65
Minimum pKa ?
10
% buried
80
Peptide accession
Q8R502
Residue number A
141
Residue number B
334
Peptide name
Volume-regulated anion channel subunit LRRC8C

Ligandability

Cysteine 141 of Volume-regulated anion channel subunit LRRC8C

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 334 of Volume-regulated anion channel subunit LRRC8C

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 Volume-regulated anion channel subunit LRRC8C between cysteines 473 and 477. However, the redox score of this cysteine pair is lower than any known redox-active intermolecular disulphide. ?

Details

Redox score ?
39
PDB code
8ben
Structure name
lrr domain structure of the lrrc8c protein
Structure deposition date
2022-10-21
Thiol separation (Å)
9
Half-sphere exposure sum ?
75
Minimum pKa ?
11
% buried
84
Peptide accession
Q8R502
Residue number A
473
Residue number B
477
Peptide name
Volume-regulated anion channel subunit LRRC8C

Ligandability

Cysteine 473 of Volume-regulated anion channel subunit LRRC8C

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 477 of Volume-regulated anion channel subunit LRRC8C

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 Volume-regulated anion channel subunit LRRC8C between cysteines 571 and 599. However, the redox score of this cysteine pair is lower than any known redox-active intermolecular disulphide. ?

Details

Redox score ?
34
PDB code
8ben
Structure name
lrr domain structure of the lrrc8c protein
Structure deposition date
2022-10-21
Thiol separation (Å)
9
Half-sphere exposure sum ?
76
Minimum pKa ?
12
% buried
90
Peptide accession
Q8R502
Residue number A
571
Residue number B
599
Peptide name
Volume-regulated anion channel subunit LRRC8C

Ligandability

Cysteine 571 of Volume-regulated anion channel subunit LRRC8C

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 599 of Volume-regulated anion channel subunit LRRC8C

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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