KinCore

Ligand: UW4

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	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

Ligand: UW4

Total number of chains: 1

Active chains: 0

Total number of genes: 1

Spatial label	Dihedral label	Number of Chains	Percent	Representative
None	None	1	100.0%	4YJNA

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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	CDPK1	Q9BJF5_TOXGO	4YJNA	Q9BJF5	43	507	507.0	UW4:601	Type1	Inactive	None	11.3388	17.6895	None	-99.71, 156.37	75.76, 16.15	-64.39, 117.75	238.76, 113.82	113.96, -20.61	out-out	out	14.2852	Saltbr-out	14.7038	HRD-in	-77.92, -57.26	80.16, -39.12	out-out-out	SNCooo	out-out	ActLoopNT-out	5.6354	ActLoopCT-out	nonTYR	APEdihe_aaooi	APEdist_iooo	APE10-dihe-na	-67.39, 123.57	APE9-dihe-na	84.59, 11.65	APE8-dihe-out	-87.39, -32.27	APE8-rot-out	50.19	APE67-dihe-in	-60.71, -30.23	-54.01, -36.14	APE12-dist-in	13.7763	APE11-dist-out	14.972	APE10-dist-out	18.7204	APE9-dist-out	12.0311	None	None	None	XRAY	2.6	0.216	0.249	A	484.0	460.0	0	27	27	0	[[51, 308]]	1.0	4yjn	Toxoplasma gondii	CAMK_CDPK1_TOXGO	CAMK	4.6e-90	307.7	1.0	256.0	256.0	194	195	196	198	200	80	99	103	171	173	172	174.0	232	221	216	215	214	213	212	211	210	129	non-specific serine/threonine protein kinase

Ligand: UW4

Total number of chains: 1

Active chains: 0

Total number of genes: 1

Spatial label	Dihedral label	Number of Chains	Percent	Representative
None	None	1	100.0%	4YJNA

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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	CDPK1	Q9BJF5_TOXGO	4YJNA	Q9BJF5	43	507	507.0	UW4:601	Type1	Inactive	None	11.3388	17.6895	None	-99.71, 156.37	75.76, 16.15	-64.39, 117.75	238.76, 113.82	113.96, -20.61	out-out	out	14.2852	Saltbr-out	14.7038	HRD-in	-77.92, -57.26	80.16, -39.12	out-out-out	SNCooo	out-out	ActLoopNT-out	5.6354	ActLoopCT-out	nonTYR	APEdihe_aaooi	APEdist_iooo	APE10-dihe-na	-67.39, 123.57	APE9-dihe-na	84.59, 11.65	APE8-dihe-out	-87.39, -32.27	APE8-rot-out	50.19	APE67-dihe-in	-60.71, -30.23	-54.01, -36.14	APE12-dist-in	13.7763	APE11-dist-out	14.972	APE10-dist-out	18.7204	APE9-dist-out	12.0311	None	None	None	XRAY	2.6	0.216	0.249	A	484.0	460.0	0	27	27	0	[[51, 308]]	1.0	4yjn	Toxoplasma gondii	CAMK_CDPK1_TOXGO	CAMK	4.6e-90	307.7	1.0	256.0	256.0	194	195	196	198	200	80	99	103	171	173	172	174.0	232	221	216	215	214	213	212	211	210	129	non-specific serine/threonine protein kinase