ReDisulphID

a tool for identifying drug-targetable redox-active disulphides

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Enoyl-CoA delta isomerase 1, mitochondrial

Intramolecular
Cysteine 150 and cysteine 155
Cysteine 150 and cysteine 161
A redox-regulated disulphide may form within Enoyl-CoA delta isomerase 1, mitochondrial between cysteines 150 and 155 (108 and 113 respectively in this structure).

Details

Redox score ?
63
PDB code
1sg4
Structure name
crystal structure of human mitochondrial delta3-delta2- enoyl-coa isomerase
Structure deposition date
2004-02-23
Thiol separation (Å)
4
Half-sphere exposure sum ?
93
Minimum pKa ?
9
% buried
100
Peptide accession
P42126
Residue number A
150
Residue number B
155
Peptide name
Enoyl-CoA delta isomerase 1, mitochondrial

Ligandability

Cysteine 150 of Enoyl-CoA delta isomerase 1, mitochondrial

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 155 of Enoyl-CoA delta isomerase 1, mitochondrial

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 Enoyl-CoA delta isomerase 1, mitochondrial between cysteines 150 and 161 (108 and 119 respectively in this structure). However, the redox score of this cysteine pair is lower than any known redox-active intermolecular disulphide. ?

Details

Redox score ?
30
PDB code
1sg4
Structure name
crystal structure of human mitochondrial delta3-delta2- enoyl-coa isomerase
Structure deposition date
2004-02-23
Thiol separation (Å)
9
Half-sphere exposure sum ?
91
Minimum pKa ?
11
% buried
100
Peptide accession
P42126
Residue number A
150
Residue number B
161
Peptide name
Enoyl-CoA delta isomerase 1, mitochondrial

Ligandability

Cysteine 150 of Enoyl-CoA delta isomerase 1, mitochondrial

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 161 of Enoyl-CoA delta isomerase 1, mitochondrial

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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