Ligand: 9AJ (Fenebrutinib)

Total number of chains: 1
Active chains: 0
Total number of genes: 1
Spatial label Dihedral label Number of Chains Percent Representative
DFGin BLBplus 1 100.0% 5VFIA
All chains
Pymol session (all) Pymol script (all)
Representatives
Pymol session (repr) Pymol script (repr)
All chains - renumbered by
Uniprot PDB Alignment
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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
TYR BTK BTK_HUMAN 5VFIA 1.59 Inactive DFGin‑BLBplus out-out out-out TYR APEdihe_oiiai APEdist_aaao 9AJ Type1 389 - 659 0 None None Tyrosine-protein kinase BTK

Ligand: 9AJ (Fenebrutinib)

Total number of chains: 3
Active chains: 0
Total number of genes: 1
Spatial label Dihedral label Number of Chains Percent Representative
DFGin BLBplus 3 100.0% 5VFIA
All chains
Pymol session (all) Pymol script (all)
Representatives
Pymol session (repr) Pymol script (repr)
All chains - renumbered by
Uniprot PDB Alignment
Download database table as tsv Go to Advanced Page
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
TYR BTK BTK_HUMAN 5VFIA 1.59 Inactive DFGin‑BLBplus out-out out-out TYR APEdihe_oiiai APEdist_aaao 9AJ Type1 389 - 659 0 None None Tyrosine-protein kinase BTK Homo sapiens
TYR BTK BTK_MOUSE 8S93A 2.1 Inactive DFGin‑BLBplus out-none out-out TYR APEdihe_oiiai APEdist_aaao 9AJ Type1 1 - 659 0 None Q91A,I92A,I94A,I95A,K430R,L542M,S543T,V555T,R562K,S564A,P565S,Y617P Tyrosine-protein kinase BTK Mus musculus
TYR BTK BTK_MOUSE 8GMBA 3.4 Inactive DFGin‑BLBplus out-none out-out TYR APEdihe_oiiai APEdist_aaao 9AJ Type1 214 - 659 0 None E298A,K300A,E301A,A384P,S386P,T387P,A388P,L390F,K430R,L542M,S543T,V555T,R562K,S564A,P565S,Y617P Tyrosine-protein kinase BTK Mus musculus

Ligand: 9AJ (Fenebrutinib)

Total number of chains: 2
Active chains: 0
Total number of genes: 1
Spatial label Dihedral label Number of Chains Percent Representative
DFGin BLBplus 2 100.0% 8S93A
All chains
Pymol session (all) Pymol script (all)
Representatives
Pymol session (repr) Pymol script (repr)
All chains - renumbered by
Uniprot PDB Alignment
Download database table as tsv Go to Advanced Page
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
TYR BTK BTK_MOUSE 8S93A 2.1 Inactive DFGin‑BLBplus out-none out-out TYR APEdihe_oiiai APEdist_aaao 9AJ Type1 1 - 659 0 None Q91A,I92A,I94A,I95A,K430R,L542M,S543T,V555T,R562K,S564A,P565S,Y617P Tyrosine-protein kinase BTK Mus musculus
TYR BTK BTK_MOUSE 8GMBA 3.4 Inactive DFGin‑BLBplus out-none out-out TYR APEdihe_oiiai APEdist_aaao 9AJ Type1 214 - 659 0 None E298A,K300A,E301A,A384P,S386P,T387P,A388P,L390F,K430R,L542M,S543T,V555T,R562K,S564A,P565S,Y617P Tyrosine-protein kinase BTK Mus musculus