KinCore

Ligand: AGI

Total number of chains: 2

Active chains: 0

Total number of genes: 2

Spatial label	Dihedral label	Number of Chains	Percent	Representative
DFGin	BLAminus	2	100.0%	5AUVA

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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
CAMK	DAPK1	DAPK1_HUMAN	5AUVA	P53355	2	277	1430.0	AGI:400	Type1	Inactive	DFGin	6.734	14.268	BLAminus	-121.04, -179.4	61.52, 77.17	-91.85, 23.98	285.97, 78.67	-63.31, -20.15	in-in	in	9.437	Saltbr-in	2.729	HRD-in	-79.03, -46.27	68.71, 3.16	in-in-out	SNCiio	in-out	ActLoopNT-in	2.899	ActLoopCT-out	nonTYR	APEdihe_aaiii	APEdist_iooi	APE10-dihe-na	-159.64, 115.03	APE9-dihe-na	-97.18, -138.91	APE8-dihe-in	-84.18, 124.61	APE8-rot-in	299.08	APE67-dihe-in	-60.52, -25.6	-47.24, -41.03	APE12-dist-in	11.653	APE11-dist-out	6.502	APE10-dist-out	9.319	APE9-dist-in	4.55	None	None	None	XRAY	1.5	0.176	0.194	A	293	275	1	0	0	0	[[13, 275]]	1.0	5auv	CAMK_DAPK1_HUMAN	CAMK	6.1e-95	323.3	1	256	256	160	161	162	164	166	42	64	68	136	138	137	139	199	187	182	181	180	179	178	177	176	94	Death-associated protein kinase 1
CMGC	CSNK2A1	CSK21_HUMAN	3AMYA	P68400	2	328	391.0	AGI:336	Type1	Inactive	DFGin	7.581	16.471	BLAminus	-112.68, -179.35	53.46, 75.04	-93.53, 24.06	293.44, 84.58	-73.39, -19.91	in-in	in	9.324	Saltbr-in	2.575	HRD-in	-80.61, -47.24	70.1, 4.18	in-in-out	SNCiio	in-out	ActLoopNT-in	2.831	ActLoopCT-out	nonTYR	APEdihe_aaioi	APEdist_iiii	APE10-dihe-na	-54.12, 158.83	APE9-dihe-na	73.08, 157.52	APE8-dihe-in	-71.83, 144.75	APE8-rot-out	182.2	APE67-dihe-in	-71.24, -17.73	-48.49, -41.13	APE12-dist-in	12.737	APE11-dist-in	9.901	APE10-dist-in	5.859	APE9-dist-in	3.322	None	None	None	XRAY	2.3	0.269	0.34	A	340	318	9	0	0	0	[[39, 324]]	1.0	3amy	CMGC_CSNK2A1_HUMAN	CMGC	1.4e-69	240.5	1	301	301	174	175	176	178	180	68	81	85	153	155	154	156	214	201	196	195	194	193	192	191	190	114	Casein kinase II subunit alpha

Ligand: AGI

Total number of chains: 3

Active chains: 0

Total number of genes: 3

Spatial label	Dihedral label	Number of Chains	Percent	Representative
DFGin	BLAminus	3	100.0%	4DGMA

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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
CAMK	DAPK1	DAPK1_HUMAN	5AUVA	P53355	2	277	1430.0	AGI:400	Type1	Inactive	DFGin	6.734	14.268	BLAminus	-121.04, -179.4	61.52, 77.17	-91.85, 23.98	285.97, 78.67	-63.31, -20.15	in-in	in	9.437	Saltbr-in	2.729	HRD-in	-79.03, -46.27	68.71, 3.16	in-in-out	SNCiio	in-out	ActLoopNT-in	2.899	ActLoopCT-out	nonTYR	APEdihe_aaiii	APEdist_iooi	APE10-dihe-na	-159.64, 115.03	APE9-dihe-na	-97.18, -138.91	APE8-dihe-in	-84.18, 124.61	APE8-rot-in	299.08	APE67-dihe-in	-60.52, -25.6	-47.24, -41.03	APE12-dist-in	11.653	APE11-dist-out	6.502	APE10-dist-out	9.319	APE9-dist-in	4.55	None	None	None	XRAY	1.5	0.176	0.194	A	293	275	1	0	0	0	[[13, 275]]	1.0	5auv	Homo sapiens	CAMK_DAPK1_HUMAN	CAMK	6.1e-95	323.3	1	256	256	160	161	162	164	166	42	64	68	136	138	137	139	199	187	182	181	180	179	178	177	176	94	Death-associated protein kinase 1
CMGC	CSNK2A1	CSK21_HUMAN	3AMYA	P68400	2	328	391.0	AGI:336	Type1	Inactive	DFGin	7.581	16.471	BLAminus	-112.68, -179.35	53.46, 75.04	-93.53, 24.06	293.44, 84.58	-73.39, -19.91	in-in	in	9.324	Saltbr-in	2.575	HRD-in	-80.61, -47.24	70.1, 4.18	in-in-out	SNCiio	in-out	ActLoopNT-in	2.831	ActLoopCT-out	nonTYR	APEdihe_aaioi	APEdist_iiii	APE10-dihe-na	-54.12, 158.83	APE9-dihe-na	73.08, 157.52	APE8-dihe-in	-71.83, 144.75	APE8-rot-out	182.2	APE67-dihe-in	-71.24, -17.73	-48.49, -41.13	APE12-dist-in	12.737	APE11-dist-in	9.901	APE10-dist-in	5.859	APE9-dist-in	3.322	None	None	None	XRAY	2.3	0.269	0.34	A	340	318	9	0	0	0	[[39, 324]]	1.0	3amy	Homo sapiens	CMGC_CSNK2A1_HUMAN	CMGC	1.4e-69	240.5	1	301	301	174	175	176	178	180	68	81	85	153	155	154	156	214	201	196	195	194	193	192	191	190	114	Casein kinase II subunit alpha
CMGC	ACK2	CSK2A_MAIZE	4DGMA	P28523	2	327	332.0	AGI:60406	Type1	Inactive	DFGin	7.49	16.202	BLAminus	-112.35, -179.55	51.43, 77.66	-87.95, 18.11	295.87, 82.64	-69.43, -18.52	in-in	in	9.434	Saltbr-in	2.697	HRD-in	-73.39, -49.46	70.54, 10.87	in-in-out	SNCiio	in-out	ActLoopNT-in	2.872	ActLoopCT-out	nonTYR	APEdihe_aaioi	APEdist_iiii	APE10-dihe-na	-129.66, 172.79	APE9-dihe-na	60.81, 153.47	APE8-dihe-in	-77.61, 144.08	APE8-rot-out	166.28	APE67-dihe-in	-62.87, -16.55	-41.41, -52.26	APE12-dist-in	12.532	APE11-dist-in	10.213	APE10-dist-in	6.019	APE9-dist-in	2.971	None	None	None	XRAY	1.65	0.213	0.252	A	326	326	0	0	0	0	[[34, 319]]	1.0	4dgm	Zea mays	CMGC_ACK2_MAIZE	CMGC	1.3e-65	227.5	1	301	301	169	170	171	173	175	63	76	80	148	150	149	151	209	196	191	190	189	188	187	186	185	109	Casein kinase II subunit alpha

Ligand: AGI

Total number of chains: 1

Active chains: 0

Total number of genes: 1

Spatial label	Dihedral label	Number of Chains	Percent	Representative
DFGin	BLAminus	1	100.0%	4DGMA

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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
CMGC	ACK2	CSK2A_MAIZE	4DGMA	P28523	2	327	332.0	AGI:60406	Type1	Inactive	DFGin	7.49	16.202	BLAminus	-112.35, -179.55	51.43, 77.66	-87.95, 18.11	295.87, 82.64	-69.43, -18.52	in-in	in	9.434	Saltbr-in	2.697	HRD-in	-73.39, -49.46	70.54, 10.87	in-in-out	SNCiio	in-out	ActLoopNT-in	2.872	ActLoopCT-out	nonTYR	APEdihe_aaioi	APEdist_iiii	APE10-dihe-na	-129.66, 172.79	APE9-dihe-na	60.81, 153.47	APE8-dihe-in	-77.61, 144.08	APE8-rot-out	166.28	APE67-dihe-in	-62.87, -16.55	-41.41, -52.26	APE12-dist-in	12.532	APE11-dist-in	10.213	APE10-dist-in	6.019	APE9-dist-in	2.971	None	None	None	XRAY	1.65	0.213	0.252	A	326	326	0	0	0	0	[[34, 319]]	1.0	4dgm	Zea mays	CMGC_ACK2_MAIZE	CMGC	1.3e-65	227.5	1	301	301	169	170	171	173	175	63	76	80	148	150	149	151	209	196	191	190	189	188	187	186	185	109	Casein kinase II subunit alpha