KinCore

Ligand: VBD

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%	6VXUC

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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	6VXUC	Q99986	21	341	396.0	VBD:401	Type1.5_Back	Inactive	DFGin	7.9334	14.9556	BLAminus	-114.75, 176.59	73.33, 87.38	-108.59, 17.26	298.01, 82.77	-60.97, -33.91	in-in	in	8.1733	Saltbr-in	2.6846	HRD-in	-87.36, -50.03	77.04, 3.64	in-in-out	SNCiio	in-out	ActLoopNT-in	2.9135	ActLoopCT-out	nonTYR	APEdihe_aaiii	APEdist_nnoi	APE10-dihe-na	999.0, 160.08	APE9-dihe-na	85.99, -159.26	APE8-dihe-in	-100.21, 133.91	APE8-rot-in	299.72	APE67-dihe-in	-64.32, -38.52	-60.23, -41.06	APE12-dist-none	999.0	APE11-dist-none	999.0	APE10-dist-out	8.067	APE9-dist-in	3.7302	K34A,K35A,E36A,E212A,K214A,E215A,E292A,K293A,K295A,K359A,K360A	None	None	XRAY	2.0	0.185	0.203	C	364.0	311.0	10	35	31	4	[[37, 326]]	1.0	6vxu	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: VBD

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%	6VXUC

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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	6VXUC	Q99986	21	341	396.0	VBD:401	Type1.5_Back	Inactive	DFGin	7.9334	14.9556	BLAminus	-114.75, 176.59	73.33, 87.38	-108.59, 17.26	298.01, 82.77	-60.97, -33.91	in-in	in	8.1733	Saltbr-in	2.6846	HRD-in	-87.36, -50.03	77.04, 3.64	in-in-out	SNCiio	in-out	ActLoopNT-in	2.9135	ActLoopCT-out	nonTYR	APEdihe_aaiii	APEdist_nnoi	APE10-dihe-na	999.0, 160.08	APE9-dihe-na	85.99, -159.26	APE8-dihe-in	-100.21, 133.91	APE8-rot-in	299.72	APE67-dihe-in	-64.32, -38.52	-60.23, -41.06	APE12-dist-none	999.0	APE11-dist-none	999.0	APE10-dist-out	8.067	APE9-dist-in	3.7302	K34A,K35A,E36A,E212A,K214A,E215A,E292A,K293A,K295A,K359A,K360A	None	None	XRAY	2.0	0.185	0.203	C	364.0	311.0	10	35	31	4	[[37, 326]]	1.0	6vxu	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: VBD

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