ReDisulphID

a tool for identifying drug-targetable redox-active disulphides

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Kinetochore-associated protein 1

Intramolecular
Cysteine 967 and cysteine 980
Cysteine 1451 and cysteine 1458
Cysteine 1107 and cysteine 1111
Cysteine 1919 and cysteine 1939
Cysteine 74 and cysteine 390
Cysteine 2031 and cysteine 2041
Cysteine 1143 and cysteine 1155
Cysteine 1107 and cysteine 1155
Cysteine 2041 and cysteine 2078
Cysteine 1087 and cysteine 1107
A redox-regulated disulphide may form within Kinetochore-associated protein 1 between cysteines 967 and 980.

Details

Redox score ?
77
PDB code
7qpg
Structure name
human rzz kinetochore corona complex
Structure deposition date
2022-01-04
Thiol separation (Å)
3
Half-sphere exposure sum ?
64
Minimum pKa ?
10
% buried
43
Peptide accession
P50748
Residue number A
967
Residue number B
980
Peptide name
Kinetochore-associated protein 1

Ligandability

Cysteine 967 of Kinetochore-associated protein 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 980 of Kinetochore-associated protein 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.

A redox-regulated disulphide may form within Kinetochore-associated protein 1 between cysteines 1451 and 1458.

Details

Redox score ?
70
PDB code
7qpg
Structure name
human rzz kinetochore corona complex
Structure deposition date
2022-01-04
Thiol separation (Å)
5
Half-sphere exposure sum ?
56
Minimum pKa ?
10
% buried
32
Peptide accession
P50748
Residue number A
1451
Residue number B
1458
Peptide name
Kinetochore-associated protein 1

Ligandability

Cysteine 1451 of Kinetochore-associated protein 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 1458 of Kinetochore-associated protein 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.

A redox-regulated disulphide may form within Kinetochore-associated protein 1 between cysteines 1107 and 1111.

Details

Redox score ?
64
PDB code
7qpg
Structure name
human rzz kinetochore corona complex
Structure deposition date
2022-01-04
Thiol separation (Å)
5
Half-sphere exposure sum ?
84
Minimum pKa ?
8
% buried
96
Peptide accession
P50748
Residue number A
1107
Residue number B
1111
Peptide name
Kinetochore-associated protein 1

Ligandability

Cysteine 1107 of Kinetochore-associated protein 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 1111 of Kinetochore-associated protein 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.

A redox-regulated disulphide may form within Kinetochore-associated protein 1 between cysteines 1919 and 1939. However, the redox score of this cysteine pair is lower than any known redox-active intermolecular disulphide. ?

Details

Redox score ?
56
PDB code
7qpg
Structure name
human rzz kinetochore corona complex
Structure deposition date
2022-01-04
Thiol separation (Å)
7
Half-sphere exposure sum ?
46
Minimum pKa ?
9
% buried
42
Peptide accession
P50748
Residue number A
1919
Residue number B
1939
Peptide name
Kinetochore-associated protein 1

Ligandability

Cysteine 1919 of Kinetochore-associated protein 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 1939 of Kinetochore-associated protein 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.

A redox-regulated disulphide may form within Kinetochore-associated protein 1 between cysteines 74 and 390. However, the redox score of this cysteine pair is lower than any known redox-active intermolecular disulphide. ?

Details

Redox score ?
46
PDB code
7qpg
Structure name
human rzz kinetochore corona complex
Structure deposition date
2022-01-04
Thiol separation (Å)
8
Half-sphere exposure sum ?
67
Minimum pKa ?
10
% buried
82
Peptide accession
P50748
Residue number A
74
Residue number B
390
Peptide name
Kinetochore-associated protein 1

Ligandability

Cysteine 74 of Kinetochore-associated protein 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 390 of Kinetochore-associated protein 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.

A redox-regulated disulphide may form within Kinetochore-associated protein 1 between cysteines 2031 and 2041. However, the redox score of this cysteine pair is lower than any known redox-active intermolecular disulphide. ?

Details

Redox score ?
42
PDB code
7qpg
Structure name
human rzz kinetochore corona complex
Structure deposition date
2022-01-04
Thiol separation (Å)
9
Half-sphere exposure sum ?
58
Minimum pKa ?
10
% buried
29
Peptide accession
P50748
Residue number A
2031
Residue number B
2041
Peptide name
Kinetochore-associated protein 1

Ligandability

Cysteine 2031 of Kinetochore-associated protein 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 2041 of Kinetochore-associated protein 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.

A redox-regulated disulphide may form within Kinetochore-associated protein 1 between cysteines 1143 and 1155. However, the redox score of this cysteine pair is lower than any known redox-active intermolecular disulphide. ?

Details

Redox score ?
39
PDB code
7qpg
Structure name
human rzz kinetochore corona complex
Structure deposition date
2022-01-04
Thiol separation (Å)
9
Half-sphere exposure sum ?
72
Minimum pKa ?
12
% buried
96
Peptide accession
P50748
Residue number A
1143
Residue number B
1155
Peptide name
Kinetochore-associated protein 1

Ligandability

Cysteine 1143 of Kinetochore-associated protein 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 1155 of Kinetochore-associated protein 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.

A redox-regulated disulphide may form within Kinetochore-associated protein 1 between cysteines 1107 and 1155. However, the redox score of this cysteine pair is lower than any known redox-active intermolecular disulphide. ?

Details

Redox score ?
38
PDB code
7qpg
Structure name
human rzz kinetochore corona complex
Structure deposition date
2022-01-04
Thiol separation (Å)
7
Half-sphere exposure sum ?
86
Minimum pKa ?
14
% buried
100
Peptide accession
P50748
Residue number A
1107
Residue number B
1155
Peptide name
Kinetochore-associated protein 1

Ligandability

Cysteine 1107 of Kinetochore-associated protein 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 1155 of Kinetochore-associated protein 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.

A redox-regulated disulphide may form within Kinetochore-associated protein 1 between cysteines 2041 and 2078. However, the redox score of this cysteine pair is lower than any known redox-active intermolecular disulphide. ?

Details

Redox score ?
31
PDB code
7qpg
Structure name
human rzz kinetochore corona complex
Structure deposition date
2022-01-04
Thiol separation (Å)
10
Half-sphere exposure sum ?
80
Minimum pKa ?
11
% buried
79
Peptide accession
P50748
Residue number A
2041
Residue number B
2078
Peptide name
Kinetochore-associated protein 1

Ligandability

Cysteine 2041 of Kinetochore-associated protein 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 2078 of Kinetochore-associated protein 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.

A redox-regulated disulphide may form within Kinetochore-associated protein 1 between cysteines 1087 and 1107. However, the redox score of this cysteine pair is lower than any known redox-active intermolecular disulphide. ?

Details

Redox score ?
29
PDB code
7qpg
Structure name
human rzz kinetochore corona complex
Structure deposition date
2022-01-04
Thiol separation (Å)
10
Half-sphere exposure sum ?
86
Minimum pKa ?
11
% buried
93
Peptide accession
P50748
Residue number A
1087
Residue number B
1107
Peptide name
Kinetochore-associated protein 1

Ligandability

Cysteine 1087 of Kinetochore-associated protein 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 1107 of Kinetochore-associated protein 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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