ReDisulphID

a tool for identifying drug-targetable redox-active disulphides

Bestrophin

Intermolecular
Cysteine 108 and cysteine 189
Cysteine 185 and cysteine 108
Intramolecular
Cysteine 185 and cysteine 221
Cysteine 185 and cysteine 189
Cysteine 69 and cysteine 251
A redox-regulated disulphide may form between two units of Bestrophin at cysteines 108 and 189.

Details

Redox score ?
62
PDB code
6vx6
Structure name
bestrophin-2 ca2+-bound state (250 nm ca2+)
Structure deposition date
2020-02-21
Thiol separation (Å)
5
Half-sphere exposure sum ?
98
Minimum pKa ?
8
% buried
100
Peptide A name
Bestrophin
Peptide B name
Bestrophin
Peptide A accession
E1BF86
Peptide B accession
E1BF86
Peptide A residue number
108
Peptide B residue number
189

Ligandability

Cysteine 108 of Bestrophin

Cysteine 189 of Bestrophin

A redox-regulated disulphide may form between two units of Bestrophin at cysteines 185 and 108. However, the redox score of this cysteine pair is lower than any known redox-active intermolecular disulphide. ?

Details

Redox score ?
56
PDB code
6vx9
Structure name
bestrophin-2 ca2+- unbound state 1 (egta only)
Structure deposition date
2020-02-21
Thiol separation (Å)
6
Half-sphere exposure sum ?
97
Minimum pKa ?
8
% buried
100
Peptide A name
Bestrophin
Peptide B name
Bestrophin
Peptide A accession
E1BF86
Peptide B accession
E1BF86
Peptide A residue number
185
Peptide B residue number
108

Ligandability

Cysteine 185 of Bestrophin

Cysteine 108 of Bestrophin

A redox-regulated disulphide may form within Bestrophin between cysteines 185 and 221. However, the redox score of this cysteine pair is lower than any known redox-active intermolecular disulphide. ?

Details

Redox score ?
51
PDB code
6vx5
Structure name
bestrophin-2 ca2+- unbound state (250 nm ca2+)
Structure deposition date
2020-02-21
Thiol separation (Å)
6
Half-sphere exposure sum ?
89
Minimum pKa ?
12
% buried
100
Peptide accession
E1BF86
Residue number A
185
Residue number B
221
Peptide name
Bestrophin

Ligandability

Cysteine 185 of Bestrophin

Cysteine 221 of Bestrophin

A redox-regulated disulphide may form within Bestrophin between cysteines 185 and 189. However, the redox score of this cysteine pair is lower than any known redox-active intermolecular disulphide. ?

Details

Redox score ?
39
PDB code
6vx9
Structure name
bestrophin-2 ca2+- unbound state 1 (egta only)
Structure deposition date
2020-02-21
Thiol separation (Å)
7
Half-sphere exposure sum ?
91
Minimum pKa ?
12
% buried
100
Peptide accession
E1BF86
Residue number A
185
Residue number B
189
Peptide name
Bestrophin

Ligandability

Cysteine 185 of Bestrophin

Cysteine 189 of Bestrophin

A redox-regulated disulphide may form within Bestrophin between cysteines 69 and 251. However, the redox score of this cysteine pair is lower than any known redox-active intermolecular disulphide. ?

Details

Redox score ?
31
PDB code
6vx9
Structure name
bestrophin-2 ca2+- unbound state 1 (egta only)
Structure deposition date
2020-02-21
Thiol separation (Å)
10
Half-sphere exposure sum ?
67
Minimum pKa ?
11
% buried
84
Peptide accession
E1BF86
Residue number A
69
Residue number B
251
Peptide name
Bestrophin

Ligandability

Cysteine 69 of Bestrophin

Cysteine 251 of Bestrophin

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