ReDisulphID

a tool for identifying drug-targetable redox-active disulphides

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Mothers against decapentaplegic homolog 1

Intramolecular
Cysteine 360 and cysteine 372
Cysteine 347 and cysteine 378
A redox-regulated disulphide may form within Mothers against decapentaplegic homolog 1 between cysteines 360 and 372.

Details

Redox score ?
68
PDB code
1khu
Structure name
smad1 crystal structure reveals the details of bmp signaling pathway
Structure deposition date
2001-12-01
Thiol separation (Å)
5
Half-sphere exposure sum ?
72
Minimum pKa ?
7
% buried
64
Peptide accession
Q15797
Residue number A
360
Residue number B
372
Peptide name
Mothers against decapentaplegic homolog 1

Ligandability

Cysteine 360 of Mothers against decapentaplegic homolog 1

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 372 of Mothers against decapentaplegic homolog 1

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 Mothers against decapentaplegic homolog 1 between cysteines 347 and 378. However, the redox score of this cysteine pair is lower than any known redox-active intermolecular disulphide. ?

Details

Redox score ?
54
PDB code
1khu
Structure name
smad1 crystal structure reveals the details of bmp signaling pathway
Structure deposition date
2001-12-01
Thiol separation (Å)
7
Half-sphere exposure sum ?
56
Minimum pKa ?
9
% buried
25
Peptide accession
Q15797
Residue number A
347
Residue number B
378
Peptide name
Mothers against decapentaplegic homolog 1

Ligandability

Cysteine 347 of Mothers against decapentaplegic homolog 1

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 378 of Mothers against decapentaplegic homolog 1

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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