ReDisulphID

a tool for identifying drug-targetable redox-active disulphides

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mRNA cap guanine-N7 methyltransferase

Intramolecular
Cysteine 206 and cysteine 236
Cysteine 225 and cysteine 236
Cysteine 283 and cysteine 287
Cysteine 281 and cysteine 283
Cysteine 206 and cysteine 225
Cysteine 281 and cysteine 287
Cysteine 281 and cysteine 305
Cysteine 287 and cysteine 305
Cysteine 283 and cysteine 305
A redox-regulated disulphide may form within mRNA cap guanine-N7 methyltransferase between cysteines 206 and 236.

Details

Redox score ?
77
PDB code
5e9w
Structure name
crystal structure of mrna cap guanine-n7 methyltransferase obtained by limited proteolysis
Structure deposition date
2015-10-15
Thiol separation (Å)
4
Half-sphere exposure sum ?
76
Minimum pKa ?
4
% buried
87
Peptide accession
O43148
Residue number A
206
Residue number B
236
Peptide name
mRNA cap guanine-N7 methyltransferase

Ligandability

Cysteine 206 of mRNA cap guanine-N7 methyltransferase

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 236 of mRNA cap guanine-N7 methyltransferase

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 mRNA cap guanine-N7 methyltransferase between cysteines 225 and 236.

Details

Redox score ?
77
PDB code
5e9j
Structure name
crystal structure of the mrna cap guanine-n7 methyltransferase - modular lobe (416-456) deletion
Structure deposition date
2015-10-15
Thiol separation (Å)
4
Half-sphere exposure sum ?
81
Minimum pKa ?
4
% buried
84
Peptide accession
O43148
Residue number A
225
Residue number B
236
Peptide name
mRNA cap guanine-N7 methyltransferase

Ligandability

Cysteine 225 of mRNA cap guanine-N7 methyltransferase

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 236 of mRNA cap guanine-N7 methyltransferase

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 mRNA cap guanine-N7 methyltransferase between cysteines 283 and 287.

Details

Redox score ?
70
PDB code
5e8j
Structure name
crystal structure of mrna cap guanine-n7 methyltransferase in complex with ram
Structure deposition date
2015-10-14
Thiol separation (Å)
3
Half-sphere exposure sum ?
87
Minimum pKa ?
9
% buried
100
Peptide accession
O43148
Residue number A
283
Residue number B
287
Peptide name
mRNA cap guanine-N7 methyltransferase

Ligandability

Cysteine 283 of mRNA cap guanine-N7 methyltransferase

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 287 of mRNA cap guanine-N7 methyltransferase

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 mRNA cap guanine-N7 methyltransferase between cysteines 281 and 283. However, the redox score of this cysteine pair is lower than any known redox-active intermolecular disulphide. ?

Details

Redox score ?
58
PDB code
5e9j
Structure name
crystal structure of the mrna cap guanine-n7 methyltransferase - modular lobe (416-456) deletion
Structure deposition date
2015-10-15
Thiol separation (Å)
4
Half-sphere exposure sum ?
87
Minimum pKa ?
11
% buried
100
Peptide accession
O43148
Residue number A
281
Residue number B
283
Peptide name
mRNA cap guanine-N7 methyltransferase

Ligandability

Cysteine 281 of mRNA cap guanine-N7 methyltransferase

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 283 of mRNA cap guanine-N7 methyltransferase

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 mRNA cap guanine-N7 methyltransferase between cysteines 206 and 225 (43 and 62 respectively in this structure). However, the redox score of this cysteine pair is lower than any known redox-active intermolecular disulphide. ?

Details

Redox score ?
51
PDB code
3epp
Structure name
crystal structure of mrna cap guanine-n7 methyltransferase (rnmt) in complex with sinefungin
Structure deposition date
2008-09-29
Thiol separation (Å)
5
Half-sphere exposure sum ?
87
Minimum pKa ?
14
% buried
95
Peptide accession
O43148
Residue number A
206
Residue number B
225
Peptide name
mRNA cap guanine-N7 methyltransferase

Ligandability

Cysteine 206 of mRNA cap guanine-N7 methyltransferase

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 225 of mRNA cap guanine-N7 methyltransferase

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 mRNA cap guanine-N7 methyltransferase between cysteines 281 and 287 (118 and 124 respectively in this structure). However, the redox score of this cysteine pair is lower than any known redox-active intermolecular disulphide. ?

Details

Redox score ?
41
PDB code
3epp
Structure name
crystal structure of mrna cap guanine-n7 methyltransferase (rnmt) in complex with sinefungin
Structure deposition date
2008-09-29
Thiol separation (Å)
8
Half-sphere exposure sum ?
86
Minimum pKa ?
9
% buried
100
Peptide accession
O43148
Residue number A
281
Residue number B
287
Peptide name
mRNA cap guanine-N7 methyltransferase

Ligandability

Cysteine 281 of mRNA cap guanine-N7 methyltransferase

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 287 of mRNA cap guanine-N7 methyltransferase

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 mRNA cap guanine-N7 methyltransferase between cysteines 281 and 305 (118 and 142 respectively in this structure). However, the redox score of this cysteine pair is lower than any known redox-active intermolecular disulphide. ?

Details

Redox score ?
41
PDB code
3epp
Structure name
crystal structure of mrna cap guanine-n7 methyltransferase (rnmt) in complex with sinefungin
Structure deposition date
2008-09-29
Thiol separation (Å)
7
Half-sphere exposure sum ?
88
Minimum pKa ?
12
% buried
100
Peptide accession
O43148
Residue number A
281
Residue number B
305
Peptide name
mRNA cap guanine-N7 methyltransferase

Ligandability

Cysteine 281 of mRNA cap guanine-N7 methyltransferase

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 305 of mRNA cap guanine-N7 methyltransferase

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 mRNA cap guanine-N7 methyltransferase between cysteines 287 and 305 (123 and 141 respectively in this structure). However, the redox score of this cysteine pair is lower than any known redox-active intermolecular disulphide. ?

Details

Redox score ?
32
PDB code
3bgv
Structure name
crystal structure of mrna cap guanine-n7 methyltransferase in complex with sah
Structure deposition date
2007-11-27
Thiol separation (Å)
9
Half-sphere exposure sum ?
88
Minimum pKa ?
13
% buried
100
Peptide accession
O43148
Residue number A
287
Residue number B
305
Peptide name
mRNA cap guanine-N7 methyltransferase

Ligandability

Cysteine 287 of mRNA cap guanine-N7 methyltransferase

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 305 of mRNA cap guanine-N7 methyltransferase

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 mRNA cap guanine-N7 methyltransferase between cysteines 283 and 305 (120 and 142 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
3epp
Structure name
crystal structure of mrna cap guanine-n7 methyltransferase (rnmt) in complex with sinefungin
Structure deposition date
2008-09-29
Thiol separation (Å)
9
Half-sphere exposure sum ?
84
Minimum pKa ?
12
% buried
100
Peptide accession
O43148
Residue number A
283
Residue number B
305
Peptide name
mRNA cap guanine-N7 methyltransferase

Ligandability

Cysteine 283 of mRNA cap guanine-N7 methyltransferase

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 305 of mRNA cap guanine-N7 methyltransferase

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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