KinCore

PDB: 1MRY — AGC AKT2_HUMAN

Total number of chains: 1

Active chains: 0

Total number of genes: 1

Spatial label	Dihedral label	Number of Chains	Percent	Representative
DFGout	None	1	100.0%	1MRYA

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Group	Gene	SwissprotID	PDB	UniprotID	First_obs_res	Last_obs_res	Length_Unp	Ligand	Ligand_type	Activity_label	Spatial_label	Phe_Glu4_dis	Phe_Lys_dis	Dihedral_label	XDFG φ,ψ	DFG-Asp φ,ψ	DFG-Phe φ,ψ	DFG-Phe χ1,χ2	DFG-Gly φ,ψ	ChelixSaltbr_label	Chelix_label	Lys_Glu_dis	Saltbr_label	LysNZ_GluOE_dis	HRD_label	His φ,ψ	Arg φ,ψ	SNC_label	SNCpymol_label	ActLoop_label	ActLoopNT_label	DFG6_XHRD_dis	ActLoopCT_label	APEtype	APEdihe_label	APEdist_label	APE10_dihe_label	APE10 φ,ψ	APE9_dihe_label	APE9 φ,ψ	APE8_dihe_label	APE8 φ,ψ	APE8_rotamer_label	APE8 χ1	APE67_label	APE6 φ,ψ	APE7 φ,ψ	APE12_dist_label	APE12_DFG4_dis	APE11_dist_label	APE11_DFG4_dis	APE10_dist_label	APE10_DFG4_dis	APE9_dist_label	APE9_Arg_dis	Chain_mut	Chain_phos	Modified_aa	Method	Resolution	Rvalue	FreeRvalue	Chain_id	ChainLen	Ordered_residues	DomainBreak	ActLoopLength	ActLoopResolvedResidues	ActLoopDisorderedResidues	Kinase_domains_Unp	N_Kinase_domains_Unp	pdb	Kincore_name	hmm	Evalue	Score	hmmbeg	hmmend	hmmlen	XDFGnum	DFGnum	PHEnum	DFG4num	DFG6num	LYSnum	GLUnum	GLU4num	XHRDnum	ARGnum	HRDnum	HRDaspnum	aFaspnum	APEnum	APE6num	APE7num	APE8num	APE9num	APE10num	APE11num	APE12num	Hinge1num	Protein_name
AGC	AKT2	AKT2_HUMAN	1MRYA	P31751	146	440	481.0	No_ligand	No_ligand	Inactive	DFGout	12.7563	7.9894	None	-121.34, 168.73	-126.98, 50.44	-103.46, -121.56	310.73, 158.04	172.34, 79.61	none-none	none	999.0	Saltbr-none	999.0	HRD-in	-73.55, -34.24	66.17, -25.77	none-none-out	SNCnno	none-out	ActLoopNT-none	999.0	ActLoopCT-out	nonTYR	APEdihe_aaioo	APEdist_nnio	APE10-dihe-na	999.0, 178.93	APE9-dihe-na	-93.7, 48.0	APE8-dihe-in	-94.52, 126.11	APE8-rot-out	162.32	APE67-dihe-out	-83.28, 134.12	-46.1, 120.91	APE12-dist-none	999.0	APE11-dist-none	999.0	APE10-dist-in	7.4839	APE9-dist-out	16.4904	None	None	None	XRAY	2.8	0.227	0.272	A	339.0	270.0	25	28	15	13	[[152, 409]]	1.0	1mry	AGC_AKT2_HUMAN	AGC	1.8e-99	338.0	1.0	260.0	260.0	292	293	294	296	298	181	200	204	272	274	273	275.0	332	320	315	314	313	312	311	310	309	230	RAC-beta serine/threonine-protein kinase

PDB: 1MRY — AGC AKT2_HUMAN

Total number of chains: 1

Active chains: 0

Total number of genes: 1

Spatial label	Dihedral label	Number of Chains	Percent	Representative
DFGout	None	1	100.0%	1MRYA

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Group	Gene	SwissprotID	PDB	UniprotID	First_obs_res	Last_obs_res	Length_Unp	Ligand	Ligand_type	Activity_label	Spatial_label	Phe_Glu4_dis	Phe_Lys_dis	Dihedral_label	XDFG φ,ψ	DFG-Asp φ,ψ	DFG-Phe φ,ψ	DFG-Phe χ1,χ2	DFG-Gly φ,ψ	ChelixSaltbr_label	Chelix_label	Lys_Glu_dis	Saltbr_label	LysNZ_GluOE_dis	HRD_label	His φ,ψ	Arg φ,ψ	SNC_label	SNCpymol_label	ActLoop_label	ActLoopNT_label	DFG6_XHRD_dis	ActLoopCT_label	APEtype	APEdihe_label	APEdist_label	APE10_dihe_label	APE10 φ,ψ	APE9_dihe_label	APE9 φ,ψ	APE8_dihe_label	APE8 φ,ψ	APE8_rotamer_label	APE8 χ1	APE67_label	APE6 φ,ψ	APE7 φ,ψ	APE12_dist_label	APE12_DFG4_dis	APE11_dist_label	APE11_DFG4_dis	APE10_dist_label	APE10_DFG4_dis	APE9_dist_label	APE9_Arg_dis	Chain_mut	Chain_phos	Modified_aa	Method	Resolution	Rvalue	FreeRvalue	Chain_id	ChainLen	Ordered_residues	DomainBreak	ActLoopLength	ActLoopResolvedResidues	ActLoopDisorderedResidues	Kinase_domains_Unp	N_Kinase_domains_Unp	pdb	Species	Kincore_name	hmm	Evalue	Score	hmmbeg	hmmend	hmmlen	XDFGnum	DFGnum	PHEnum	DFG4num	DFG6num	LYSnum	GLUnum	GLU4num	XHRDnum	ARGnum	HRDnum	HRDaspnum	aFaspnum	APEnum	APE6num	APE7num	APE8num	APE9num	APE10num	APE11num	APE12num	Hinge1num	Protein_name
AGC	AKT2	AKT2_HUMAN	1MRYA	P31751	146	440	481.0	No_ligand	No_ligand	Inactive	DFGout	12.7563	7.9894	None	-121.34, 168.73	-126.98, 50.44	-103.46, -121.56	310.73, 158.04	172.34, 79.61	none-none	none	999.0	Saltbr-none	999.0	HRD-in	-73.55, -34.24	66.17, -25.77	none-none-out	SNCnno	none-out	ActLoopNT-none	999.0	ActLoopCT-out	nonTYR	APEdihe_aaioo	APEdist_nnio	APE10-dihe-na	999.0, 178.93	APE9-dihe-na	-93.7, 48.0	APE8-dihe-in	-94.52, 126.11	APE8-rot-out	162.32	APE67-dihe-out	-83.28, 134.12	-46.1, 120.91	APE12-dist-none	999.0	APE11-dist-none	999.0	APE10-dist-in	7.4839	APE9-dist-out	16.4904	None	None	None	XRAY	2.8	0.227	0.272	A	339.0	270.0	25	28	15	13	[[152, 409]]	1.0	1mry	Homo sapiens	AGC_AKT2_HUMAN	AGC	1.8e-99	338.0	1.0	260.0	260.0	292	293	294	296	298	181	200	204	272	274	273	275.0	332	320	315	314	313	312	311	310	309	230	RAC-beta serine/threonine-protein kinase

PDB: 1MRY — AGC AKT2_HUMAN

Total number of chains: 0

Active chains: 0

Total number of genes: 0

Spatial label	Dihedral label	Number of Chains	Percent	Representative

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Group	Gene	SwissprotID	PDB	UniprotID	First_obs_res	Last_obs_res	Length_Unp	Ligand	Ligand_type	Activity_label	Spatial_label	Phe_Glu4_dis	Phe_Lys_dis	Dihedral_label	XDFG φ,ψ	DFG-Asp φ,ψ	DFG-Phe φ,ψ	DFG-Phe χ1,χ2	DFG-Gly φ,ψ	ChelixSaltbr_label	Chelix_label	Lys_Glu_dis	Saltbr_label	LysNZ_GluOE_dis	HRD_label	His φ,ψ	Arg φ,ψ	SNC_label	SNCpymol_label	ActLoop_label	ActLoopNT_label	DFG6_XHRD_dis	ActLoopCT_label	APEtype	APEdihe_label	APEdist_label	APE10_dihe_label	APE10 φ,ψ	APE9_dihe_label	APE9 φ,ψ	APE8_dihe_label	APE8 φ,ψ	APE8_rotamer_label	APE8 χ1	APE67_label	APE6 φ,ψ	APE7 φ,ψ	APE12_dist_label	APE12_DFG4_dis	APE11_dist_label	APE11_DFG4_dis	APE10_dist_label	APE10_DFG4_dis	APE9_dist_label	APE9_Arg_dis	Chain_mut	Chain_phos	Modified_aa	Method	Resolution	Rvalue	FreeRvalue	Chain_id	ChainLen	Ordered_residues	DomainBreak	ActLoopLength	ActLoopResolvedResidues	ActLoopDisorderedResidues	Kinase_domains_Unp	N_Kinase_domains_Unp	pdb	Species	Kincore_name	hmm	Evalue	Score	hmmbeg	hmmend	hmmlen	XDFGnum	DFGnum	PHEnum	DFG4num	DFG6num	LYSnum	GLUnum	GLU4num	XHRDnum	ARGnum	HRDnum	HRDaspnum	aFaspnum	APEnum	APE6num	APE7num	APE8num	APE9num	APE10num	APE11num	APE12num	Hinge1num	Protein_name