a tool for identifying drug-targetable redox-active disulphides

Tumor necrosis factor

Intramolecular

Cysteine 144 and cysteine 176

A redox-regulated disulphide may form within Tumor necrosis factor between cysteines 144 and 176 (69 and 101 respectively in this structure).

Details

Redox score ?

85

PDB code

Structure name

tnfalpha-certolizumab fab

Structure deposition date

2016-12-21

Thiol separation (Å)

2

Half-sphere exposure sum ?

51

Minimum pK_a ?

nan

% buried

nan

Peptide accession

Residue number A

144

Residue number B

176

Peptide name

Tumor necrosis factor

Ligandability

Cysteine 144 of Tumor necrosis factor

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 176 of Tumor necrosis factor

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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