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5WDY

Crystal structure of WNK1 in complex with 1-cyclohexyl-N-({6-fluoro-1-[2-(3-methoxyphenyl)pyridin-4-yl]-1H-indol-3-yl}methyl)methanamine (compound 6)

Functional Information from GO Data
ChainGOidnamespacecontents
A0004672molecular_functionprotein kinase activity
A0005524molecular_functionATP binding
A0006468biological_processprotein phosphorylation
B0004672molecular_functionprotein kinase activity
B0005524molecular_functionATP binding
B0006468biological_processprotein phosphorylation
Functional Information from PDB Data
site_idAC1
Number of Residues9
Detailsbinding site for residue ANP A 901
ChainResidue
AGLY228
AGLY230
ASER231
ALYS233
AVAL235
AGLU302
AMET304
ALYS351
AMN904

site_idAC2
Number of Residues11
Detailsbinding site for residue A6S A 902
ChainResidue
APHE265
AGLU268
AALA269
ALEU272
AVAL281
APHE283
ALEU299
AASP368
ALEU369
AGLY370
AALA372

site_idAC3
Number of Residues1
Detailsbinding site for residue MN A 903
ChainResidue
AHOH1007

site_idAC4
Number of Residues4
Detailsbinding site for residue MN A 904
ChainResidue
AASN354
AASP368
AANP901
AHOH1005

site_idAC5
Number of Residues3
Detailsbinding site for residue MN B 501
ChainResidue
BASN354
BASP368
BANP502

site_idAC6
Number of Residues8
Detailsbinding site for residue ANP B 502
ChainResidue
BGLY230
BLYS233
BVAL235
BGLU302
BLEU303
BMET304
BASP368
BMN501

site_idAC7
Number of Residues12
Detailsbinding site for residue A6S B 503
ChainResidue
BPHE265
BGLU268
BALA269
BLEU272
BVAL281
BPHE283
BSER286
BASP368
BLEU369
BGLY370
BALA372
BLEU374

Functional Information from PROSITE/UniProt
site_idPS00108
Number of Residues13
DetailsPROTEIN_KINASE_ST Serine/Threonine protein kinases active-site signature. IiHrDLKcdNIFI
ChainResidueDetails
AILE345-ILE357

Functional Information from SwissProt/UniProt
site_idSWS_FT_FI1
Number of Residues2
DetailsACT_SITE: Proton acceptor => ECO:0000305|PubMed:16263722
ChainResidueDetails
AASP368
BASP368

site_idSWS_FT_FI2
Number of Residues6
DetailsBINDING: BINDING => ECO:0000269|PubMed:27712055, ECO:0000305|PubMed:28771350, ECO:0007744|PDB:5TF9, ECO:0007744|PDB:5WDY, ECO:0007744|PDB:5WE8
ChainResidueDetails
ASER231
ATHR301
ALYS351
BSER231
BTHR301
BLYS351

site_idSWS_FT_FI3
Number of Residues8
DetailsBINDING: BINDING => ECO:0000250|UniProtKB:Q9JIH7
ChainResidueDetails
APHE283
ALEU299
ALEU369
ALEU371
BPHE283
BLEU299
BLEU369
BLEU371

site_idSWS_FT_FI4
Number of Residues2
DetailsMOD_RES: Phosphoserine; by autocatalysis => ECO:0000269|PubMed:31656913
ChainResidueDetails
AASP378
BASP378

site_idSWS_FT_FI5
Number of Residues2
DetailsMOD_RES: Phosphoserine; by autocatalysis => ECO:0000269|PubMed:15883153, ECO:0000269|PubMed:16263722, ECO:0000269|PubMed:16832045, ECO:0000269|PubMed:17190791, ECO:0000269|PubMed:31656913, ECO:0000269|PubMed:34289367
ChainResidueDetails
ASER382
BSER382

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PDB entries from 2024-04-24

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