Structure of PDB 5ci7 Chain A

Receptor sequence
>5ci7A (length=277) Species: 9606 (Homo sapiens) [Search protein sequence]
PGRGGTETVGKFEFSRKDLIGHGAFAVVFKGRHRAAHDLEVAVKCINKKN
LAKSQTLLGKEIKILKELKHENIVALYDFQEMANSVYLVMEYCNGGDLAD
YLHAMRTLSEDTIRLFLQQIAGAMRLLHSKGIIHRDLKPQNILLSNPAGR
RANPNSIRVKIADFGFARYLQSNMMAATLCGSPMYMAPEVIMSQHYDGKA
DLWSIGTIVYQCLTGKAPFQASSPQDLRLFYEKNKTLVPTIPRETSAPLR
QLLLALLQRNHKDRMDFDEFFHHPFLD
3D structure
PDB5ci7 Discovery and structure of a new inhibitor scaffold of the autophagy initiating kinase ULK1.
ChainA
Resolution1.74 Å
3D
structure
Catalytic site residues are labeled in the structure
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Enzymatic activity
Catalytic site (original residue number in PDB) D138 K140 Q142 N143 D165 S184
Catalytic site (residue number reindexed from 1) D136 K138 Q140 N141 D163 S182
Enzyme Commision number 2.7.11.1: non-specific serine/threonine protein kinase.
Interaction with ligand
Site
#		 Ligand Ligand
chain		 Binding residues on receptor
(original residue number in PDB)		 Binding residues on receptor
(residue number reindexed from 1)		 Binding affinity
BS01 51W A I22 A44 M92 Y94 C95 G98 L145 I20 A42 M90 Y92 C93 G96 L143 MOAD: ic50=120nM
PDBbind-CN: -logKd/Ki=6.92,IC50=120nM
BindingDB: IC50=120nM
Gene Ontology
Molecular Function
GO:0004672 protein kinase activity
GO:0004674 protein serine/threonine kinase activity
GO:0005524 ATP binding
Biological Process
GO:0006468 protein phosphorylation
GO:0010506 regulation of autophagy

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Molecular Function
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Biological Process
External links
PDB RCSB:5ci7, PDBe:5ci7, PDBj:5ci7
PDBsum5ci7
PubMed26275681
UniProtO75385|ULK1_HUMAN Serine/threonine-protein kinase ULK1 (Gene Name=ULK1)

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