a tool for identifying drug-targetable redox-active disulphides

Enoyl-CoA delta isomerase 2

Intramolecular

Cysteine 282 and cysteine 368 L

A redox-regulated disulphide may form within Enoyl-CoA delta isomerase 2 between cysteines 282 and 368 (247 and 333 respectively in this structure). However, the redox score of this cysteine pair is lower than any known redox-active intermolecular disulphide. ?

Details

Redox score ?

35

PDB code

Structure name

crystal structure of human peroxisomal delta3,delta2, enoyl-coa isomerase (iso-eci2)

Structure deposition date

2014-07-15

Thiol separation (Å)

8

Half-sphere exposure sum ?

79

Minimum pK_a ?

12

% buried

80

Peptide accession

Residue number A

282

Residue number B

368

Peptide name

Enoyl-CoA delta isomerase 2

Ligandability

Cysteine 282 of Enoyl-CoA delta isomerase 2

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.

Ligandable in the dataset of Cao et al.

Not ligandable in the dataset of Kuljanin et al.

Cysteine 368 of Enoyl-CoA delta isomerase 2

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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