Ligand: LWJ (Zolagratinib)

Total number of chains: 2
Active chains: 0
Total number of genes: 1
Spatial label Dihedral label Number of Chains Percent Representative
DFGin BLAplus 1 50.0% 5B7VA
DFGin BLBplus 1 50.0% 5B7VB
All chains
Pymol session (all) Pymol script (all)
Representatives
Pymol session (repr) Pymol script (repr)
All chains - renumbered by
Uniprot PDB Alignment
Hover over column headers for tooltip help.

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
TYR FGFR1 FGFR1_HUMAN 5B7VA P11362 464 763 822.0 LWJ:801 Type1.5_Back Inactive DFGin 5.579 13.1223 BLAplus -124.02, 164.1 56.03, 35.18 -83.98, -18.11 54.48, 82.39 -93.9, 14.98 in-in in 7.6751 Saltbr-in 3.0247 HRD-in -66.75, -56.97 82.51, -19.31 in-out-out SNCioo out-out ActLoopNT-out 8.5813 ActLoopCT-out TYR APEdihe_iioai APEdist_aaao APE10-dihe-in -115.75, 145.14 APE9-dihe-in -88.05, 111.6 APE8-dihe-out -54.86, -24.86 APE8-rot-na 336.86 APE67-dihe-in -69.24, -8.96 -56.43, -23.01 APE12-dist-na 20.9664 APE11-dist-na 21.6298 APE10-dist-na 19.6578 APE9-dist-out 12.0193 L457V,C488A,C584S None None XRAY 2.15 0.224 0.256 A 310.0 282.0 18 30 27 3 [[478, 756]] 1.0 5b7v TYR_FGFR1_HUMAN TYR 1.4e-104 354.9 1.0 260.0 260.0 640 641 642 644 646 514 531 535 620 622 621 623.0 682 670 665 664 663 662 661 660 659 562 Fibroblast growth factor receptor 1
TYR FGFR1 FGFR1_HUMAN 5B7VB P11362 462 762 822.0 LWJ:801 Type1.5_Back Inactive DFGin 5.6766 12.94 BLBplus -116.05, 161.84 53.01, 39.08 -76.06, 133.86 41.64, 92.29 65.64, 39.87 in-in in 7.6165 Saltbr-in 3.029 HRD-in -64.13, -51.82 87.54, -28.51 in-out-out SNCioo out-out ActLoopNT-out 9.4405 ActLoopCT-out TYR APEdihe_iioai APEdist_aaao APE10-dihe-in -94.62, 144.39 APE9-dihe-in -82.91, 115.57 APE8-dihe-out -50.0, -27.69 APE8-rot-na 330.02 APE67-dihe-in -70.22, -11.34 -61.05, -21.38 APE12-dist-na 999.0 APE11-dist-na 19.9984 APE10-dist-na 18.2427 APE9-dist-out 11.7021 L457V,C488A,C584S None None XRAY 2.15 0.224 0.256 B 310.0 277.0 24 30 24 6 [[478, 756]] 1.0 5b7v TYR_FGFR1_HUMAN TYR 1.4e-104 354.9 1.0 260.0 260.0 640 641 642 644 646 514 531 535 620 622 621 623.0 682 670 665 664 663 662 661 660 659 562 Fibroblast growth factor receptor 1

Ligand: LWJ (Zolagratinib)

Total number of chains: 2
Active chains: 0
Total number of genes: 1
Spatial label Dihedral label Number of Chains Percent Representative
DFGin BLAplus 1 50.0% 5B7VA
DFGin BLBplus 1 50.0% 5B7VB
All chains
Pymol session (all) Pymol script (all)
Representatives
Pymol session (repr) Pymol script (repr)
All chains - renumbered by
Uniprot PDB Alignment
Hover over column headers for tooltip help.

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
TYR FGFR1 FGFR1_HUMAN 5B7VA P11362 464 763 822.0 LWJ:801 Type1.5_Back Inactive DFGin 5.579 13.1223 BLAplus -124.02, 164.1 56.03, 35.18 -83.98, -18.11 54.48, 82.39 -93.9, 14.98 in-in in 7.6751 Saltbr-in 3.0247 HRD-in -66.75, -56.97 82.51, -19.31 in-out-out SNCioo out-out ActLoopNT-out 8.5813 ActLoopCT-out TYR APEdihe_iioai APEdist_aaao APE10-dihe-in -115.75, 145.14 APE9-dihe-in -88.05, 111.6 APE8-dihe-out -54.86, -24.86 APE8-rot-na 336.86 APE67-dihe-in -69.24, -8.96 -56.43, -23.01 APE12-dist-na 20.9664 APE11-dist-na 21.6298 APE10-dist-na 19.6578 APE9-dist-out 12.0193 L457V,C488A,C584S None None XRAY 2.15 0.224 0.256 A 310.0 282.0 18 30 27 3 [[478, 756]] 1.0 5b7v Homo sapiens TYR_FGFR1_HUMAN TYR 1.4e-104 354.9 1.0 260.0 260.0 640 641 642 644 646 514 531 535 620 622 621 623.0 682 670 665 664 663 662 661 660 659 562 Fibroblast growth factor receptor 1
TYR FGFR1 FGFR1_HUMAN 5B7VB P11362 462 762 822.0 LWJ:801 Type1.5_Back Inactive DFGin 5.6766 12.94 BLBplus -116.05, 161.84 53.01, 39.08 -76.06, 133.86 41.64, 92.29 65.64, 39.87 in-in in 7.6165 Saltbr-in 3.029 HRD-in -64.13, -51.82 87.54, -28.51 in-out-out SNCioo out-out ActLoopNT-out 9.4405 ActLoopCT-out TYR APEdihe_iioai APEdist_aaao APE10-dihe-in -94.62, 144.39 APE9-dihe-in -82.91, 115.57 APE8-dihe-out -50.0, -27.69 APE8-rot-na 330.02 APE67-dihe-in -70.22, -11.34 -61.05, -21.38 APE12-dist-na 999.0 APE11-dist-na 19.9984 APE10-dist-na 18.2427 APE9-dist-out 11.7021 L457V,C488A,C584S None None XRAY 2.15 0.224 0.256 B 310.0 277.0 24 30 24 6 [[478, 756]] 1.0 5b7v Homo sapiens TYR_FGFR1_HUMAN TYR 1.4e-104 354.9 1.0 260.0 260.0 640 641 642 644 646 514 531 535 620 622 621 623.0 682 670 665 664 663 662 661 660 659 562 Fibroblast growth factor receptor 1

Ligand: LWJ (Zolagratinib)

Total number of chains: 0
Active chains: 0
Total number of genes: 0
Spatial label Dihedral label Number of Chains Percent Representative
All chains
Pymol session (all) Pymol script (all)
Representatives
Pymol session (repr) Pymol script (repr)
All chains - renumbered by
Uniprot PDB Alignment
Hover over column headers for tooltip help.

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