Ligand: BYL

Total number of chains: 3
Active chains: 1
Total number of genes: 2
Spatial label Dihedral label Number of Chains Percent Representative
DFGin BLAminus 3 100.0% 7SUJA

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Family Gene UniprotID PDB Resolution Activity Spatial-Dihedral Chelix-SaltBridge ActLoopNT-ActLoopCT APEtype APEdihe APEdist Ligand Ligand Type Residues in structure Unresolved residues in A-loop Phosphorylation Mutation Protein
CAMK CHEK1 CHK1_HUMAN 7SUJA 2.299 Inactive DFGin‑BLAminus in-out in-in nonTYR APEdihe_aaiii APEdist_iiii BYL Type1 9 - 271 0 None N59L,V68I,L84M,Y86L,C87A,E91S,E134H,S147A,F149Y,G150S Serine/threonine-protein kinase Chk1
CAMK CHEK1 CHK1_HUMAN 7SUJB 2.299 Active DFGin‑BLAminus in-in in-in nonTYR APEdihe_aaiii APEdist_iiii BYL Type1 9 - 271 0 None N59L,V68I,L84M,Y86L,C87A,E91S,E134H,S147A,F149Y,G150S Serine/threonine-protein kinase Chk1
TYR EGFR EGFR_HUMAN 9NJ7A 2.53 None DFGin‑BLAminus in-in in-none TYR APEdihe_nniai APEdist_aaai A1BYL Type1 698 - 1017 0 None None Epidermal growth factor receptor

Ligand: BYL

Total number of chains: 3
Active chains: 1
Total number of genes: 2
Spatial label Dihedral label Number of Chains Percent Representative
DFGin BLAminus 3 100.0% 7SUJA

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Family Gene UniprotID PDB Resolution Activity Spatial-Dihedral Chelix-SaltBridge ActLoopNT-ActLoopCT APEtype APEdihe APEdist Ligand Ligand Type Residues in structure Unresolved residues in A-loop Phosphorylation Mutation Protein Organism
CAMK CHEK1 CHK1_HUMAN 7SUJA 2.299 Inactive DFGin‑BLAminus in-out in-in nonTYR APEdihe_aaiii APEdist_iiii BYL Type1 9 - 271 0 None N59L,V68I,L84M,Y86L,C87A,E91S,E134H,S147A,F149Y,G150S Serine/threonine-protein kinase Chk1 Homo sapiens
CAMK CHEK1 CHK1_HUMAN 7SUJB 2.299 Active DFGin‑BLAminus in-in in-in nonTYR APEdihe_aaiii APEdist_iiii BYL Type1 9 - 271 0 None N59L,V68I,L84M,Y86L,C87A,E91S,E134H,S147A,F149Y,G150S Serine/threonine-protein kinase Chk1 Homo sapiens
TYR EGFR EGFR_HUMAN 9NJ7A 2.53 None DFGin‑BLAminus in-in in-none TYR APEdihe_nniai APEdist_aaai A1BYL Type1 698 - 1017 0 None None Epidermal growth factor receptor Homo sapiens

Ligand: BYL

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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Family Gene UniprotID PDB Resolution Activity Spatial-Dihedral Chelix-SaltBridge ActLoopNT-ActLoopCT APEtype APEdihe APEdist Ligand Ligand Type Residues in structure Unresolved residues in A-loop Phosphorylation Mutation Protein Organism