a tool for identifying drug-targetable redox-active disulphides

Alpha-defensin 1

Intramolecular

Cysteine 68 and cysteine 84

A redox-regulated disulphide may form within Alpha-defensin 1 between cysteines 68 and 84 (4 and 20 respectively in this structure).

Details

Redox score ?

84

PDB code

Structure name

the solution structure of defa1, a highly potent antimicrobial peptide from the horse

Structure deposition date

2015-01-12

Thiol separation (Å)

2

Half-sphere exposure sum ?

50

Minimum pK_a ?

nan

% buried

nan

Peptide accession

Residue number A

68

Residue number B

84

Peptide name

Alpha-defensin 1

Ligandability

Cysteine 68 of Alpha-defensin 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 84 of Alpha-defensin 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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