Serine/threonine-protein kinase TNNI3K

Intermolecular

Intramolecular

A redox-regulated disulphide may form between two units of Serine/threonine-protein kinase TNNI3K at cysteines 705 and 705. However, the redox score of this cysteine pair is lower than any known redox-active intermolecular disulphide. ?

Details

Redox score ?

PDB code

7mgj

Structure name

tnni3k complexed with n-methyl-4-(4-(3-(3-(trifluoromethyl) phenyl) ureido) phenoxy)picolinamide

Structure deposition date

2021-04-12

Thiol separation (Å)

Half-sphere exposure sum ?

Minimum pK_a ?

% buried

Peptide A name

Serine/threonine-protein kinase TNNI3K

Peptide B name

Serine/threonine-protein kinase TNNI3K

Peptide A accession

Q59H18

Peptide B accession

Q59H18

Peptide A residue number

705

Peptide B residue number

705

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 Serine/threonine-protein kinase TNNI3K between cysteines 722 and 724. However, the redox score of this cysteine pair is lower than any known redox-active intermolecular disulphide. ?

Details

Redox score ?

PDB code

7mgk

Structure name

tnni3k complexed with 1-(3,5-dichloro-4-((6-(methylamino)pyrimidin-4- yl)oxy)phenyl)-3-(3-(trifluoromethyl)phenyl)urea

Structure deposition date

2021-04-12

Thiol separation (Å)

Half-sphere exposure sum ?

Minimum pK_a ?

% buried

Peptide accession

Q59H18

Residue number A

722

Residue number B

724

Peptide name

Serine/threonine-protein kinase TNNI3K

Ligandability

Cysteine 722 of Serine/threonine-protein kinase TNNI3K

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 724 of Serine/threonine-protein kinase TNNI3K

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 Serine/threonine-protein kinase TNNI3K between cysteines 482 and 528. However, the redox score of this cysteine pair is lower than any known redox-active intermolecular disulphide. ?