KinCore

Ligand: Q8B

Total number of chains: 2

Active chains: 1

Total number of genes: 2

Spatial label	Dihedral label	Number of Chains	Percent	Representative
DFGin	BLAminus	2	100.0%	6Z5AA

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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
CMGC	CLK3	CLK3_HUMAN	6Z51A	P49761	134	484	490.0	Q8B:519	Type1	Active	DFGin	7.644	14.723	BLAminus	-120.67, -179.68	66.19, 73.26	-95.29, 10.0	295.31, 104.01	-60.15, -26.73	in-in	in	8.709	Saltbr-in	3.035	HRD-in	-72.92, -51.22	80.31, -10.03	in-in-in	SNCiii	in-in	ActLoopNT-in	2.804	ActLoopCT-in	nonTYR	APEdihe_aaiii	APEdist_iiii	APE10-dihe-na	-133.16, 171.75	APE9-dihe-na	81.7, 153.34	APE8-dihe-in	-75.14, 140.03	APE8-rot-in	295.39	APE67-dihe-in	-59.48, -23.48	-45.0, -48.32	APE12-dist-in	13.964	APE11-dist-in	12.029	APE10-dist-in	7.635	APE9-dist-in	2.998	None	None	None	XRAY	1.92	0.165	0.208	A	360	351	0	0	0	0	[[156, 472]]	1.0	6z51	CMGC_CLK3_HUMAN	CMGC	1.2e-90	309.6	1	301	301	319	320	321	323	325	186	201	205	280	282	281	283	356	344	339	338	337	336	335	334	333	237	Dual specificity protein kinase CLK3
OTHER	HASPIN	HASP_HUMAN	6Z5AA	Q8TF76	465	798	798.0	Q8B:60807	Type1.5_Front	Inactive	DFGin	4.746	13.158	BLAminus	-130.52, 170.23	77.78, 97.19	-110.55, 22.86	309.49, 126.33	-50.19, -42.61	out-out	out	10.928	Saltbr-out	6.049	HRD-na-N	-69.87, -51.48	73.76, 2.92	out-in-na	SNCoia	in-na	ActLoopNT-in	2.957	ActLoopCT-na	noAPE	APEdihe_aaaaa	APEdist_aaaa	APE10-dihe-na	-114.05, 16.57	APE9-dihe-na	-70.55, 162.23	APE8-dihe-na	-152.03, 159.2	APE8-rot-na	218.93	APE67-dihe-na	-157.88, 144.9	96.43, 3.83	APE12-dist-na	9.408	APE11-dist-na	13.313	APE10-dist-na	16.953	APE9-dist-na	12.968	None	None	None	XRAY	1.55	0.157	0.182	A	357	334	0	0	0	0	[[484, 797]]	1.0	6z5a	OTHER_HASPIN_HUMAN	HASP	1.4e-226	756.6	1	314	314	686	687	688	690	692	511	535	539	646	648	647	649	741	721	716	715	714	713	712	711	710	604	Serine/threonine-protein kinase haspin

Ligand: Q8B

Total number of chains: 2

Active chains: 1

Total number of genes: 2

Spatial label	Dihedral label	Number of Chains	Percent	Representative
DFGin	BLAminus	2	100.0%	6Z5AA

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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	CLK3	CLK3_HUMAN	6Z51A	P49761	134	484	490.0	Q8B:519	Type1	Active	DFGin	7.644	14.723	BLAminus	-120.67, -179.68	66.19, 73.26	-95.29, 10.0	295.31, 104.01	-60.15, -26.73	in-in	in	8.709	Saltbr-in	3.035	HRD-in	-72.92, -51.22	80.31, -10.03	in-in-in	SNCiii	in-in	ActLoopNT-in	2.804	ActLoopCT-in	nonTYR	APEdihe_aaiii	APEdist_iiii	APE10-dihe-na	-133.16, 171.75	APE9-dihe-na	81.7, 153.34	APE8-dihe-in	-75.14, 140.03	APE8-rot-in	295.39	APE67-dihe-in	-59.48, -23.48	-45.0, -48.32	APE12-dist-in	13.964	APE11-dist-in	12.029	APE10-dist-in	7.635	APE9-dist-in	2.998	None	None	None	XRAY	1.92	0.165	0.208	A	360	351	0	0	0	0	[[156, 472]]	1.0	6z51	Homo sapiens	CMGC_CLK3_HUMAN	CMGC	1.2e-90	309.6	1	301	301	319	320	321	323	325	186	201	205	280	282	281	283	356	344	339	338	337	336	335	334	333	237	Dual specificity protein kinase CLK3
OTHER	HASPIN	HASP_HUMAN	6Z5AA	Q8TF76	465	798	798.0	Q8B:60807	Type1.5_Front	Inactive	DFGin	4.746	13.158	BLAminus	-130.52, 170.23	77.78, 97.19	-110.55, 22.86	309.49, 126.33	-50.19, -42.61	out-out	out	10.928	Saltbr-out	6.049	HRD-na-N	-69.87, -51.48	73.76, 2.92	out-in-na	SNCoia	in-na	ActLoopNT-in	2.957	ActLoopCT-na	noAPE	APEdihe_aaaaa	APEdist_aaaa	APE10-dihe-na	-114.05, 16.57	APE9-dihe-na	-70.55, 162.23	APE8-dihe-na	-152.03, 159.2	APE8-rot-na	218.93	APE67-dihe-na	-157.88, 144.9	96.43, 3.83	APE12-dist-na	9.408	APE11-dist-na	13.313	APE10-dist-na	16.953	APE9-dist-na	12.968	None	None	None	XRAY	1.55	0.157	0.182	A	357	334	0	0	0	0	[[484, 797]]	1.0	6z5a	Homo sapiens	OTHER_HASPIN_HUMAN	HASP	1.4e-226	756.6	1	314	314	686	687	688	690	692	511	535	539	646	648	647	649	741	721	716	715	714	713	712	711	710	604	Serine/threonine-protein kinase haspin

Ligand: Q8B

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