KinCore

Ligand: A1EOH

Total number of chains: 4

Active chains: 0

Total number of genes: 2

Spatial label	Dihedral label	Number of Chains	Percent	Representative
DFGin	BLAminus	2	50.0%	9U7EA
DFGin	BLAplus	2	50.0%	9U7GA

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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	DFG-Asp_rot_label	XDFG φ,ψ	DFG-Asp φ,ψ	DFG-Asp χ1,χ2	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
TYR	FGFR1	FGFR1_HUMAN	9U7GA	P11362	458	764	822.0	A1EOH:60801	Type1	Inactive	DFGin	5.224	13.194	BLAplus	DFGAsp-rot-out	-110.8434, 162.1649	63.0059, 30.9945	286.7279, -19.8958	-82.2365, -17.0655	54.7882, 88.1081	-101.8258, 13.8707	in-in	in	8.191	Saltbr-in	2.609	HRD-in	-75.8909, -50.9981	81.4767, -13.1997	in-out-out	SNCioo	out-out	ActLoopNT-out	7.756	ActLoopCT-out	TYR	APEdihe_iioai	APEdist_aaao	APE10-dihe-in	-86.5142, 149.0998	APE9-dihe-in	-108.0035, 100.2863	APE8-dihe-out	-64.4253, -16.0116	APE8-rot-na	352.8306	APE67-dihe-in	-73.7329, -10.081	-54.0958, -26.1567	APE12-dist-na	17.346	APE11-dist-na	19.691	APE10-dist-na	16.725	APE9-dist-out	11.089	None	None	None	XRAY	1.66	0.189	0.216	A	310	305	2	0	0	0	[[478, 756]]	1.0	9u7g	TYR_FGFR1_HUMAN	TYR	2.2e-104	354.4	1	260	260	640	641	642	644	646	514	531	535	620	622	621	623	682	670	665	664	663	662	661	660	659	562	Fibroblast growth factor receptor 1
TYR	FGFR1	FGFR1_HUMAN	9U7GB	P11362	458	763	822.0	A1EOH:60801	Type1	Inactive	DFGin	5.247	12.608	BLAplus	DFGAsp-rot-out	-112.9988, 160.3415	57.4682, 34.2443	280.1108, -19.9678	-81.7823, -13.9145	53.7843, 84.6247	-101.2657, 9.7477	in-out	in	7.581	Saltbr-out	3.662	HRD-in	-73.7348, -53.828	79.8361, -14.8034	out-none-out	SNCono	none-out	ActLoopNT-none	999.0	ActLoopCT-out	TYR	APEdihe_nnoai	APEdist_aaao	APE10-dihe-none	999.0, 999.0	APE9-dihe-none	999.0, 75.3213	APE8-dihe-out	-58.111, -21.4687	APE8-rot-na	347.3713	APE67-dihe-in	-74.7818, -2.146	-48.17, -33.8044	APE12-dist-na	999.0	APE11-dist-na	999.0	APE10-dist-na	999.0	APE9-dist-out	11.429	None	None	None	XRAY	1.66	0.189	0.216	B	310	272	34	0	0	16	[[478, 756]]	1.0	9u7g	TYR_FGFR1_HUMAN	TYR	2.2e-104	354.4	1	260	260	640	641	642	644	646	514	531	535	620	622	621	623	682	670	665	664	663	662	661	660	659	562	Fibroblast growth factor receptor 1
TYR	FGFR2	FGFR2_HUMAN	9U7EA	P21802	467	763	821.0	A1EOH:801	Type1	Inactive	DFGin	6.549	13.656	BLAminus	DFGAsp-rot-in	-127.7252, 179.5375	58.4829, 72.8644	191.1223, -1.4114	-85.7376, 19.4875	290.1554, 81.5222	-57.0249, -38.1789	in-in	in	7.453	Saltbr-in	2.7	HRD-in	-79.8283, -47.5732	67.1637, -1.2135	in-in-out	SNCiio	in-out	ActLoopNT-in	2.944	ActLoopCT-out	TYR	APEdihe_oiiai	APEdist_aaai	APE10-dihe-out	-108.0516, 23.9104	APE9-dihe-in	-100.7783, 133.922	APE8-dihe-in	-65.5276, 116.1415	APE8-rot-na	340.0537	APE67-dihe-in	-69.5758, -17.4499	-64.8995, -29.0758	APE12-dist-na	10.044	APE11-dist-na	10.904	APE10-dist-na	7.545	APE9-dist-in	4.775	None	None	None	XRAY	2.2	0.264	0.312	A	304	288	9	0	0	0	[[481, 759]]	1.0	9u7e	TYR_FGFR2_HUMAN	TYR	2.3e-104	354.3	1	260	260	643	644	645	647	649	517	534	538	623	625	624	626	685	673	668	667	666	665	664	663	662	565	Fibroblast growth factor receptor 2
TYR	FGFR2	FGFR2_HUMAN	9U7EB	P21802	467	763	821.0	A1EOH:801	Type1	Inactive	DFGin	6.522	13.627	BLAminus	DFGAsp-rot-in	-126.2217, -174.5816	53.4314, 77.0865	186.4309, 11.1155	-86.2654, 25.682	297.1005, 79.1982	-62.3955, -29.0245	in-in	in	7.691	Saltbr-in	2.712	HRD-in	-83.2379, -44.7662	66.7144, -0.5539	in-in-out	SNCiio	in-out	ActLoopNT-in	2.971	ActLoopCT-out	TYR	APEdihe_oiiai	APEdist_aaai	APE10-dihe-out	-105.141, 30.5893	APE9-dihe-in	-109.462, 130.1257	APE8-dihe-in	-58.9431, 116.1201	APE8-rot-na	16.1146	APE67-dihe-in	-73.9702, -7.0624	-65.2151, -27.8011	APE12-dist-na	15.036	APE11-dist-na	10.703	APE10-dist-na	7.585	APE9-dist-in	4.785	None	None	None	XRAY	2.2	0.264	0.312	B	304	282	15	0	0	6	[[481, 759]]	1.0	9u7e	TYR_FGFR2_HUMAN	TYR	2.3e-104	354.3	1	260	260	643	644	645	647	649	517	534	538	623	625	624	626	685	673	668	667	666	665	664	663	662	565	Fibroblast growth factor receptor 2

Ligand: A1EOH

Total number of chains: 4

Active chains: 0

Total number of genes: 2

Spatial label	Dihedral label	Number of Chains	Percent	Representative
DFGin	BLAminus	2	50.0%	9U7EA
DFGin	BLAplus	2	50.0%	9U7GA

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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	DFG-Asp_rot_label	XDFG φ,ψ	DFG-Asp φ,ψ	DFG-Asp χ1,χ2	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
TYR	FGFR1	FGFR1_HUMAN	9U7GA	P11362	458	764	822.0	A1EOH:60801	Type1	Inactive	DFGin	5.224	13.194	BLAplus	DFGAsp-rot-out	-110.8434, 162.1649	63.0059, 30.9945	286.7279, -19.8958	-82.2365, -17.0655	54.7882, 88.1081	-101.8258, 13.8707	in-in	in	8.191	Saltbr-in	2.609	HRD-in	-75.8909, -50.9981	81.4767, -13.1997	in-out-out	SNCioo	out-out	ActLoopNT-out	7.756	ActLoopCT-out	TYR	APEdihe_iioai	APEdist_aaao	APE10-dihe-in	-86.5142, 149.0998	APE9-dihe-in	-108.0035, 100.2863	APE8-dihe-out	-64.4253, -16.0116	APE8-rot-na	352.8306	APE67-dihe-in	-73.7329, -10.081	-54.0958, -26.1567	APE12-dist-na	17.346	APE11-dist-na	19.691	APE10-dist-na	16.725	APE9-dist-out	11.089	None	None	None	XRAY	1.66	0.189	0.216	A	310	305	2	0	0	0	[[478, 756]]	1.0	9u7g	Homo sapiens	TYR_FGFR1_HUMAN	TYR	2.2e-104	354.4	1	260	260	640	641	642	644	646	514	531	535	620	622	621	623	682	670	665	664	663	662	661	660	659	562	Fibroblast growth factor receptor 1
TYR	FGFR1	FGFR1_HUMAN	9U7GB	P11362	458	763	822.0	A1EOH:60801	Type1	Inactive	DFGin	5.247	12.608	BLAplus	DFGAsp-rot-out	-112.9988, 160.3415	57.4682, 34.2443	280.1108, -19.9678	-81.7823, -13.9145	53.7843, 84.6247	-101.2657, 9.7477	in-out	in	7.581	Saltbr-out	3.662	HRD-in	-73.7348, -53.828	79.8361, -14.8034	out-none-out	SNCono	none-out	ActLoopNT-none	999.0	ActLoopCT-out	TYR	APEdihe_nnoai	APEdist_aaao	APE10-dihe-none	999.0, 999.0	APE9-dihe-none	999.0, 75.3213	APE8-dihe-out	-58.111, -21.4687	APE8-rot-na	347.3713	APE67-dihe-in	-74.7818, -2.146	-48.17, -33.8044	APE12-dist-na	999.0	APE11-dist-na	999.0	APE10-dist-na	999.0	APE9-dist-out	11.429	None	None	None	XRAY	1.66	0.189	0.216	B	310	272	34	0	0	16	[[478, 756]]	1.0	9u7g	Homo sapiens	TYR_FGFR1_HUMAN	TYR	2.2e-104	354.4	1	260	260	640	641	642	644	646	514	531	535	620	622	621	623	682	670	665	664	663	662	661	660	659	562	Fibroblast growth factor receptor 1
TYR	FGFR2	FGFR2_HUMAN	9U7EA	P21802	467	763	821.0	A1EOH:801	Type1	Inactive	DFGin	6.549	13.656	BLAminus	DFGAsp-rot-in	-127.7252, 179.5375	58.4829, 72.8644	191.1223, -1.4114	-85.7376, 19.4875	290.1554, 81.5222	-57.0249, -38.1789	in-in	in	7.453	Saltbr-in	2.7	HRD-in	-79.8283, -47.5732	67.1637, -1.2135	in-in-out	SNCiio	in-out	ActLoopNT-in	2.944	ActLoopCT-out	TYR	APEdihe_oiiai	APEdist_aaai	APE10-dihe-out	-108.0516, 23.9104	APE9-dihe-in	-100.7783, 133.922	APE8-dihe-in	-65.5276, 116.1415	APE8-rot-na	340.0537	APE67-dihe-in	-69.5758, -17.4499	-64.8995, -29.0758	APE12-dist-na	10.044	APE11-dist-na	10.904	APE10-dist-na	7.545	APE9-dist-in	4.775	None	None	None	XRAY	2.2	0.264	0.312	A	304	288	9	0	0	0	[[481, 759]]	1.0	9u7e	Homo sapiens	TYR_FGFR2_HUMAN	TYR	2.3e-104	354.3	1	260	260	643	644	645	647	649	517	534	538	623	625	624	626	685	673	668	667	666	665	664	663	662	565	Fibroblast growth factor receptor 2
TYR	FGFR2	FGFR2_HUMAN	9U7EB	P21802	467	763	821.0	A1EOH:801	Type1	Inactive	DFGin	6.522	13.627	BLAminus	DFGAsp-rot-in	-126.2217, -174.5816	53.4314, 77.0865	186.4309, 11.1155	-86.2654, 25.682	297.1005, 79.1982	-62.3955, -29.0245	in-in	in	7.691	Saltbr-in	2.712	HRD-in	-83.2379, -44.7662	66.7144, -0.5539	in-in-out	SNCiio	in-out	ActLoopNT-in	2.971	ActLoopCT-out	TYR	APEdihe_oiiai	APEdist_aaai	APE10-dihe-out	-105.141, 30.5893	APE9-dihe-in	-109.462, 130.1257	APE8-dihe-in	-58.9431, 116.1201	APE8-rot-na	16.1146	APE67-dihe-in	-73.9702, -7.0624	-65.2151, -27.8011	APE12-dist-na	15.036	APE11-dist-na	10.703	APE10-dist-na	7.585	APE9-dist-in	4.785	None	None	None	XRAY	2.2	0.264	0.312	B	304	282	15	0	0	6	[[481, 759]]	1.0	9u7e	Homo sapiens	TYR_FGFR2_HUMAN	TYR	2.3e-104	354.3	1	260	260	643	644	645	647	649	517	534	538	623	625	624	626	685	673	668	667	666	665	664	663	662	565	Fibroblast growth factor receptor 2

Ligand: A1EOH

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	DFG-Asp_rot_label	XDFG φ,ψ	DFG-Asp φ,ψ	DFG-Asp χ1,χ2	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