Het-PDB Navi2 (PDB: 6I2B)

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Ligands
Code	Name		Style	Show	Link
9LQ	[2-[(4-isoquinolin-5-ylsulfonyl-1,4-diazepan-1-yl)methyl]phenyl]boronic acid				PoSSuM
RIP	Beta-D-ribopyranose				PoSSuM

Non-standard Residues
Code	Name	Show
SEP	Phosphoserine
TPO	Phosphothreonine

Glycosylation
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Modification
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Download interaction data: 6I2B

Code :

6I2B PDBj RCSB PDB PDBe

Header :

TRANSFERASE

Title :

Crystal Structure of the Protein-Kinase A catalytic subunit from Cricetulus Griseus in complex with compounds RKp153 and RKp117

Release Data :

2019-05-15

Compound :

mol_id	molecule	chains	synonym
1	cAMP-dependent protein kinase catalytic subunit alpha	A	PKA C-alpha
	ec: 2.7.11.11

mol_id	molecule	chains
2	UPF0418 protein FAM164A	D
	other_details: PKI 5-22 with T16RBT mutation. A ribose has been covalently attached to a threonine of the peptide

Source :

mol_id	organism_scientific	organism_common	expression_system
1	Cricetulus griseus (taxid:10029)	Chinese hamster	Escherichia coli 'BL21-Gold(DE3)pLysS AG' (taxid:866768)
	organ: Ovary tissue: Ovary gene: PRKACA

mol_id	organism_scientific	organism_common
2	Cricetulus griseus (taxid:10029)	Chinese hamster
	synthetic: yes

Authors :

Mueller, J.M., Heine, A., Klebe, G.

Keywords :

Complex, peptidic ligand, transferase

Exp. method :

X-RAY DIFFRACTION ( 1.97 Å )

Citation :

Conceptional Design of Self-Assembling Bisubstrate-like Inhibitors of Protein Kinase A Resulting in a Boronic Acid Glutamate Linkage

Mueller, J.M.,Kirschner, R.,Geyer, A. et al.
(2019) Acs Omega

Chain :

UniProt :

P25321 (KAPCA_CRIGR)

Reaction:	EC:	Evidence:
Reaction:	Physiological Direction:	Evidence:
ATP + L-seryl-[protein] = ADP + H(+) + O-phospho-L-seryl- [protein]	2.7.11.11	-
	-	-
ATP + L-threonyl-[protein] = ADP + H(+) + O-phospho-L- threonyl-[protein]	2.7.11.11	-
	-	-

PDB ID: 6I2B