KinCore

Ligand: FCS

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%	6CNXC

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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
CK1	VRK1	VRK1_HUMAN	6CNXC	Q99986	21	341	396.0	FCS:401	Type1.5_Back	Inactive	DFGin	7.9287	14.959	BLAminus	-117.97, 174.58	72.5, 95.69	-112.8, 14.63	298.18, 79.72	-53.03, -36.61	in-in	in	8.2695	Saltbr-in	2.6981	HRD-in	-80.65, -55.5	79.78, -0.52	in-in-out	SNCiio	in-out	ActLoopNT-in	2.885	ActLoopCT-out	nonTYR	APEdihe_aaiii	APEdist_nooi	APE10-dihe-na	-102.77, 2.4	APE9-dihe-na	89.21, -150.13	APE8-dihe-in	-109.73, 119.46	APE8-rot-in	298.92	APE67-dihe-in	-67.91, -25.71	-48.97, -43.76	APE12-dist-none	999.0	APE11-dist-out	5.5686	APE10-dist-out	10.8745	APE9-dist-in	3.8246	K34A,K35A,E36A,E212A,K214A,E215A,E292A,K293A,K295A,K359A,K360A	None	None	XRAY	2.0	0.188	0.211	C	364.0	311.0	10	35	31	4	[[37, 326]]	1.0	6cnx	CK1_VRK1_HUMAN	CK1	8.4e-105	355.8	1.0	261.0	261.0	196	197	198	200	202	71	83	87	174	176	175	177.0	243	231	226	225	224	223	222	221	220	132	Serine/threonine-protein kinase VRK1

Ligand: FCS

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%	6CNXC

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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
CK1	VRK1	VRK1_HUMAN	6CNXC	Q99986	21	341	396.0	FCS:401	Type1.5_Back	Inactive	DFGin	7.9287	14.959	BLAminus	-117.97, 174.58	72.5, 95.69	-112.8, 14.63	298.18, 79.72	-53.03, -36.61	in-in	in	8.2695	Saltbr-in	2.6981	HRD-in	-80.65, -55.5	79.78, -0.52	in-in-out	SNCiio	in-out	ActLoopNT-in	2.885	ActLoopCT-out	nonTYR	APEdihe_aaiii	APEdist_nooi	APE10-dihe-na	-102.77, 2.4	APE9-dihe-na	89.21, -150.13	APE8-dihe-in	-109.73, 119.46	APE8-rot-in	298.92	APE67-dihe-in	-67.91, -25.71	-48.97, -43.76	APE12-dist-none	999.0	APE11-dist-out	5.5686	APE10-dist-out	10.8745	APE9-dist-in	3.8246	K34A,K35A,E36A,E212A,K214A,E215A,E292A,K293A,K295A,K359A,K360A	None	None	XRAY	2.0	0.188	0.211	C	364.0	311.0	10	35	31	4	[[37, 326]]	1.0	6cnx	Homo sapiens	CK1_VRK1_HUMAN	CK1	8.4e-105	355.8	1.0	261.0	261.0	196	197	198	200	202	71	83	87	174	176	175	177.0	243	231	226	225	224	223	222	221	220	132	Serine/threonine-protein kinase VRK1

Ligand: FCS

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