2UZU

PKA structures of indazole-pyridine series of AKT inhibitors

GO（遺伝子オントロジー）由来の情報

鎖名	GO（遺伝子オントロジー）id	名前空間	内容
E	0000166	molecular_function	nucleotide binding
E	0001669	cellular_component	acrosomal vesicle
E	0001707	biological_process	mesoderm formation
E	0004672	molecular_function	protein kinase activity
E	0004674	molecular_function	protein serine/threonine kinase activity
E	0004679	molecular_function	AMP-activated protein kinase activity
E	0004691	molecular_function	cAMP-dependent protein kinase activity
E	0005515	molecular_function	protein binding
E	0005524	molecular_function	ATP binding
E	0005634	cellular_component	nucleus
E	0005737	cellular_component	cytoplasm
E	0005739	cellular_component	mitochondrion
E	0005829	cellular_component	cytosol
E	0005886	cellular_component	plasma membrane
E	0005952	cellular_component	cAMP-dependent protein kinase complex
E	0006468	biological_process	protein phosphorylation
E	0010737	biological_process	protein kinase A signaling
E	0016020	cellular_component	membrane
E	0016301	molecular_function	kinase activity
E	0016310	biological_process	phosphorylation
E	0016740	molecular_function	transferase activity
E	0018105	biological_process	peptidyl-serine phosphorylation
E	0019904	molecular_function	protein domain specific binding
E	0031594	cellular_component	neuromuscular junction
E	0034237	molecular_function	protein kinase A regulatory subunit binding
E	0034605	biological_process	cellular response to heat
E	0036126	cellular_component	sperm flagellum
E	0048471	cellular_component	perinuclear region of cytoplasm
E	0106310	molecular_function	protein serine kinase activity
E	1904262	biological_process	negative regulation of TORC1 signaling
I	0004862	molecular_function	cAMP-dependent protein kinase inhibitor activity
I	0006469	biological_process	negative regulation of protein kinase activity

PDBデータベースに由来する情報

site_id	AC1
残基数	14
詳細	BINDING SITE FOR RESIDUE L20 E1351

鎖名	残基
E	THR51
E	VAL123
E	LEU173
E	THR183
E	ASP184
E	PHE327
E	PHE54
E	GLY55
E	ARG56
E	ALA70
E	LYS72
E	LEU74
E	GLU121
E	TYR122

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UniProtにおけるモチーフ・データベースPROSITEからの機能情報

site_id	PS00107
残基数	24
詳細	PROTEIN_KINASE_ATP Protein kinases ATP-binding region signature. LGTGSFGRVMlVkhmetgnh..........YAMK

鎖名	残基	詳細
E	LEU49-LYS72

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site_id	PS00108
残基数	13
詳細	PROTEIN_KINASE_ST Serine/Threonine protein kinases active-site signature. LiYrDLKpeNLLI

鎖名	残基	詳細
E	LEU162-ILE174

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SwissProt/UniProtに記載されている蛋白質分子機能情報

site_id	SWS_FT_FI1
残基数	3
詳細	SITE: Important for inhibition => ECO:0000250

鎖名	残基	詳細
I	THR16
I	ARG19
I	ASN20

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site_id	SWS_FT_FI2
残基数	2
詳細	BINDING:

鎖名	残基	詳細
E	GLY50
E	ILE73

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site_id	SWS_FT_FI3
残基数	2
詳細	BINDING: BINDING => ECO:0000255|PROSITE-ProRule:PRU00159

鎖名	残基	詳細
E	PRO169
E	TYR122

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site_id	SWS_FT_FI4
残基数	2
詳細	MOD_RES: Phosphothreonine => ECO:0000250|UniProtKB:P17612

鎖名	残基	詳細
E	TRP196
E	LEU49

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site_id	SWS_FT_FI5
残基数	1
詳細	MOD_RES: Phosphoserine => ECO:0000250|UniProtKB:P05132

鎖名	残基	詳細
E	GLU140

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site_id	SWS_FT_FI6
残基数	1
詳細	MOD_RES: Phosphothreonine; by PDPK1 => ECO:0000269|PubMed:6262777

鎖名	残基	詳細
E	LEU198

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site_id	SWS_FT_FI7
残基数	1
詳細	MOD_RES: Phosphotyrosine => ECO:0000250|UniProtKB:P05132

鎖名	残基	詳細
E	GLU331

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site_id	SWS_FT_FI8
残基数	1
詳細	MOD_RES: Phosphoserine => ECO:0000269|PubMed:6262777

鎖名	残基	詳細
E	ILE339

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CSAにおける酵素触媒機能の情報

site_id	MCSA1
残基数	5
詳細	M-CSA 757

鎖名	残基	詳細
E	LEU167	activator, proton acceptor, proton donor
E	PRO169	electrostatic stabiliser, polar interaction
E	LEU172	metal ligand
E	PHE185	metal ligand
E	PRO202	electrostatic stabiliser, polar interaction

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