KinCore

Ligand: DJ8

Total number of chains: 1

Active chains: 0

Total number of genes: 1

Spatial label	Dihedral label	Number of Chains	Percent	Representative
DFGin	BLBminus	1	100.0%	7QGPA

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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
STE	STK10	STK10_HUMAN	7QGPA	O94804	23	313	968.0	DJ8:401	Type1.5_Front	Inactive	DFGin	6.6304	15.6466	BLBminus	-137.41, 176.17	64.63, 46.3	-55.04, 138.14	280.95, 68.0	-53.28, 137.64	in-out	in	8.4159	Saltbr-out	10.6514	HRD-in	-69.38, -55.58	84.71, -10.94	out-out-out	SNCooo	out-out	ActLoopNT-out	11.0317	ActLoopCT-out	nonTYR	APEdihe_aaiio	APEdist_iioo	APE10-dihe-na	-131.79, 8.52	APE9-dihe-na	91.31, 163.78	APE8-dihe-in	-62.99, 130.71	APE8-rot-in	298.17	APE67-dihe-out	-58.73, -25.46	-85.93, 65.94	APE12-dist-in	12.3172	APE11-dist-in	13.5639	APE10-dist-out	8.7161	APE9-dist-out	11.288	None	None	None	XRAY	1.9	0.201	0.237	A	302.0	288.0	3	28	28	0	[[36, 294]]	1.0	7qgp	STE_STK10_HUMAN	STE	4.6e-94	320.5	1.0	257.0	257.0	174	175	176	178	180	65	81	85	154	156	155	157.0	219	202	197	196	195	194	193	192	191	111	Serine/threonine-protein kinase 10

Ligand: DJ8

Total number of chains: 1

Active chains: 0

Total number of genes: 1

Spatial label	Dihedral label	Number of Chains	Percent	Representative
DFGin	BLBminus	1	100.0%	7QGPA

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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
STE	STK10	STK10_HUMAN	7QGPA	O94804	23	313	968.0	DJ8:401	Type1.5_Front	Inactive	DFGin	6.6304	15.6466	BLBminus	-137.41, 176.17	64.63, 46.3	-55.04, 138.14	280.95, 68.0	-53.28, 137.64	in-out	in	8.4159	Saltbr-out	10.6514	HRD-in	-69.38, -55.58	84.71, -10.94	out-out-out	SNCooo	out-out	ActLoopNT-out	11.0317	ActLoopCT-out	nonTYR	APEdihe_aaiio	APEdist_iioo	APE10-dihe-na	-131.79, 8.52	APE9-dihe-na	91.31, 163.78	APE8-dihe-in	-62.99, 130.71	APE8-rot-in	298.17	APE67-dihe-out	-58.73, -25.46	-85.93, 65.94	APE12-dist-in	12.3172	APE11-dist-in	13.5639	APE10-dist-out	8.7161	APE9-dist-out	11.288	None	None	None	XRAY	1.9	0.201	0.237	A	302.0	288.0	3	28	28	0	[[36, 294]]	1.0	7qgp	Homo sapiens	STE_STK10_HUMAN	STE	4.6e-94	320.5	1.0	257.0	257.0	174	175	176	178	180	65	81	85	154	156	155	157.0	219	202	197	196	195	194	193	192	191	111	Serine/threonine-protein kinase 10

Ligand: DJ8

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