ReDisulphID

a tool for identifying drug-targetable redox-active disulphides

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Malonyl-CoA decarboxylase, mitochondrial

Intermolecular
Cysteine 206 and cysteine 206 L
Cysteine 243 and cysteine 243
Intramolecular
Cysteine 402 and cysteine 448
A redox-regulated disulphide is known to form between two units of Malonyl-CoA decarboxylase, mitochondrial at cysteines 206 and 206.

Details

Redox score ?
74
PDB code
4f0x
Structure name
crystal structure of human malonyl-coa decarboxylase (peroxisomal isoform)
Structure deposition date
2012-05-05
Thiol separation (Å)
4
Half-sphere exposure sum ?
67
Minimum pKa ?
8
% buried
70
Peptide A name
Malonyl-CoA decarboxylase, mitochondrial
Peptide B name
Malonyl-CoA decarboxylase, mitochondrial
Peptide A accession
O95822
Peptide B accession
O95822
Peptide A residue number
206
Peptide B residue number
206

Ligandability

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.

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 is known to form between two units of Malonyl-CoA decarboxylase, mitochondrial at cysteines 243 and 243.

Details

Redox score ?
62
PDB code
4f0x
Structure name
crystal structure of human malonyl-coa decarboxylase (peroxisomal isoform)
Structure deposition date
2012-05-05
Thiol separation (Å)
5
Half-sphere exposure sum ?
61
Minimum pKa ?
10
% buried
67
Peptide A name
Malonyl-CoA decarboxylase, mitochondrial
Peptide B name
Malonyl-CoA decarboxylase, mitochondrial
Peptide A accession
O95822
Peptide B accession
O95822
Peptide A residue number
243
Peptide B residue number
243

Ligandability

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 Malonyl-CoA decarboxylase, mitochondrial between cysteines 402 and 448. However, the redox score of this cysteine pair is lower than any known redox-active intermolecular disulphide. ?

Details

Redox score ?
34
PDB code
4f0x
Structure name
crystal structure of human malonyl-coa decarboxylase (peroxisomal isoform)
Structure deposition date
2012-05-05
Thiol separation (Å)
9
Half-sphere exposure sum ?
84
Minimum pKa ?
11
% buried
97
Peptide accession
O95822
Residue number A
402
Residue number B
448
Peptide name
Malonyl-CoA decarboxylase, mitochondrial

Ligandability

Cysteine 402 of Malonyl-CoA decarboxylase, 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 448 of Malonyl-CoA decarboxylase, 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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