ReDisulphID

a tool for identifying drug-targetable redox-active disulphides

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BEN domain-containing protein 3

Intramolecular
Cysteine 594 and cysteine 640
Cysteine 268 and cysteine 328
A redox-regulated disulphide may form within BEN domain-containing protein 3 between cysteines 594 and 640. However, the redox score of this cysteine pair is lower than any known redox-active intermolecular disulphide. ?

Details

Redox score ?
54
PDB code
7v9h
Structure name
the ben3 domain of protein bend3
Structure deposition date
2021-08-25
Thiol separation (Å)
7
Half-sphere exposure sum ?
68
Minimum pKa ?
11
% buried
65
Peptide accession
Q6PAL0
Residue number A
594
Residue number B
640
Peptide name
BEN domain-containing protein 3

Ligandability

Cysteine 594 of BEN domain-containing protein 3

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 640 of BEN domain-containing protein 3

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 BEN domain-containing protein 3 between cysteines 268 and 328. However, the redox score of this cysteine pair is lower than any known redox-active intermolecular disulphide. ?

Details

Redox score ?
40
PDB code
5jno
Structure name
crystal structure of the bd1-ntpr complex from bend3 and pich
Structure deposition date
2016-04-30
Thiol separation (Å)
8
Half-sphere exposure sum ?
81
Minimum pKa ?
11
% buried
70
Peptide accession
Q5T5X7
Residue number A
268
Residue number B
328
Peptide name
BEN domain-containing protein 3

Ligandability

Cysteine 268 of BEN domain-containing protein 3

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 328 of BEN domain-containing protein 3

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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