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4AQC

Triazolopyridine-based Inhibitor of Janus Kinase 2

Functional Information from GO Data
ChainGOidnamespacecontents
A0004672molecular_functionprotein kinase activity
A0004713molecular_functionprotein tyrosine kinase activity
A0005524molecular_functionATP binding
A0006468biological_processprotein phosphorylation
B0004672molecular_functionprotein kinase activity
B0004713molecular_functionprotein tyrosine kinase activity
B0005524molecular_functionATP binding
B0006468biological_processprotein phosphorylation
Functional Information from PDB Data
site_idAC1
Number of Residues16
DetailsBINDING SITE FOR RESIDUE 88A A 2001
ChainResidue
AGLY856
AASN981
ALEU983
AGLY993
AASP994
AHOH2022
AHOH2084
AHOH2226
ALYS857
AGLY858
AALA880
AGLU930
ATYR931
ALEU932
AGLY935
AARG980

site_idAC2
Number of Residues3
DetailsBINDING SITE FOR RESIDUE SO4 A 2002
ChainResidue
AGLN955
AGLN959
AARG1127

site_idAC3
Number of Residues14
DetailsBINDING SITE FOR RESIDUE 88A B 2001
ChainResidue
AHOH2047
BGLY856
BLYS857
BGLY858
BALA880
BMET929
BGLU930
BLEU932
BGLY935
BASN981
BLEU983
BGLY993
BASP994
BHOH2209

site_idAC4
Number of Residues7
DetailsBINDING SITE FOR RESIDUE SO4 B 2002
ChainResidue
ATYR934
AHOH2131
AHOH2134
BGLN955
BGLN959
BARG1127
BHOH2212

site_idAC5
Number of Residues3
DetailsBINDING SITE FOR RESIDUE SO4 B 2003
ChainResidue
BARG1090
BASP1092
BGLY1093

site_idAC6
Number of Residues9
DetailsBINDING SITE FOR RESIDUE SO4 B 2004
ChainResidue
BLYS1053
BSER1054
BLYS1055
BSER1056
BALA1059
BHOH2155
BHOH2156
BHOH2160
BHOH2213

site_idAC7
Number of Residues4
DetailsBINDING SITE FOR RESIDUE SO4 B 2005
ChainResidue
AGLU946
AARG947
BLYS912
BARG989

Functional Information from PROSITE/UniProt
site_idPS00107
Number of Residues29
DetailsPROTEIN_KINASE_ATP Protein kinases ATP-binding region signature. LGKGNFGSVEmCrydplqdntgevv.....AVKK
ChainResidueDetails
ALEU855-LYS883

site_idPS00109
Number of Residues13
DetailsPROTEIN_KINASE_TYR Tyrosine protein kinases specific active-site signature. YIHrDLATRNILV
ChainResidueDetails
ATYR972-VAL984

Functional Information from SwissProt/UniProt
site_idSWS_FT_FI1
Number of Residues2
DetailsACT_SITE: Proton acceptor => ECO:0000255|PROSITE-ProRule:PRU00159, ECO:0000255|PROSITE-ProRule:PRU10028
ChainResidueDetails
AASP976
BASP976

site_idSWS_FT_FI2
Number of Residues4
DetailsBINDING: BINDING => ECO:0000255|PROSITE-ProRule:PRU00159
ChainResidueDetails
ALEU855
ALYS882
BLEU855
BLYS882

site_idSWS_FT_FI3
Number of Residues6
DetailsMOD_RES: Phosphotyrosine; by autocatalysis => ECO:0000250|UniProtKB:Q62120
ChainResidueDetails
ATYR868
ATYR966
ATYR972
BTYR868
BTYR966
BTYR972

site_idSWS_FT_FI4
Number of Residues2
DetailsMOD_RES: Phosphotyrosine; by autocatalysis => ECO:0000269|PubMed:16174768
ChainResidueDetails
APTR1007
BPTR1007

site_idSWS_FT_FI5
Number of Residues2
DetailsMOD_RES: Phosphotyrosine; by autocatalysis => ECO:0000305|PubMed:16174768
ChainResidueDetails
APTR1008
BPTR1008

224004

PDB entries from 2024-08-21

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