ReDisulphID

a tool for identifying drug-targetable redox-active disulphides

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Fetuin-B

Intramolecular
Cysteine 217 and cysteine 224
Cysteine 117 and cysteine 137
Cysteine 237 and cysteine 254
Cysteine 36 and cysteine 368
Cysteine 93 and cysteine 104
Cysteine 151 and cysteine 154
A redox-regulated disulphide may form within Fetuin-B between cysteines 217 and 224.

Details

Redox score ?
89
PDB code
7auw
Structure name
inhibitory complex of human meprin beta with mouse fetuin-b
Structure deposition date
2020-11-03
Thiol separation (Å)
2
Half-sphere exposure sum ?
35
Minimum pKa ?
nan
% buried
nan
Peptide accession
Q9QXC1
Residue number A
217
Residue number B
224
Peptide name
Fetuin-B

Ligandability

Cysteine 217 of Fetuin-B

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 224 of Fetuin-B

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 Fetuin-B between cysteines 117 and 137.

Details

Redox score ?
86
PDB code
6saz
Structure name
cleaved human fetuin-b in complex with crayfish astacin
Structure deposition date
2019-07-18
Thiol separation (Å)
2
Half-sphere exposure sum ?
68
Minimum pKa ?
nan
% buried
nan
Peptide accession
Q9UGM5
Residue number A
117
Residue number B
137
Peptide name
Fetuin-B

Ligandability

Cysteine 117 of Fetuin-B

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 137 of Fetuin-B

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 Fetuin-B between cysteines 237 and 254.

Details

Redox score ?
86
PDB code
6saz
Structure name
cleaved human fetuin-b in complex with crayfish astacin
Structure deposition date
2019-07-18
Thiol separation (Å)
2
Half-sphere exposure sum ?
70
Minimum pKa ?
nan
% buried
nan
Peptide accession
Q9UGM5
Residue number A
237
Residue number B
254
Peptide name
Fetuin-B

Ligandability

Cysteine 237 of Fetuin-B

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 254 of Fetuin-B

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 Fetuin-B between cysteines 36 and 368.

Details

Redox score ?
84
PDB code
6saz
Structure name
cleaved human fetuin-b in complex with crayfish astacin
Structure deposition date
2019-07-18
Thiol separation (Å)
2
Half-sphere exposure sum ?
59
Minimum pKa ?
nan
% buried
nan
Peptide accession
Q9UGM5
Residue number A
36
Residue number B
368
Peptide name
Fetuin-B

Ligandability

Cysteine 36 of Fetuin-B

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 368 of Fetuin-B

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 Fetuin-B between cysteines 93 and 104.

Details

Redox score ?
84
PDB code
6saz
Structure name
cleaved human fetuin-b in complex with crayfish astacin
Structure deposition date
2019-07-18
Thiol separation (Å)
2
Half-sphere exposure sum ?
63
Minimum pKa ?
nan
% buried
nan
Peptide accession
Q9UGM5
Residue number A
93
Residue number B
104
Peptide name
Fetuin-B

Ligandability

Cysteine 93 of Fetuin-B

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 104 of Fetuin-B

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 Fetuin-B between cysteines 151 and 154.

Details

Redox score ?
82
PDB code
6saz
Structure name
cleaved human fetuin-b in complex with crayfish astacin
Structure deposition date
2019-07-18
Thiol separation (Å)
2
Half-sphere exposure sum ?
76
Minimum pKa ?
nan
% buried
nan
Peptide accession
Q9UGM5
Residue number A
151
Residue number B
154
Peptide name
Fetuin-B

Ligandability

Cysteine 151 of Fetuin-B

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 154 of Fetuin-B

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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