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6I5K

Crystal structure of CLK1 in complexed with furo[3,2-b]pyridine compound VN345 (derivative of compound 12h)

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
C0004672molecular_functionprotein kinase activity
C0005524molecular_functionATP binding
C0006468biological_processprotein phosphorylation
Functional Information from PDB Data
site_idAC1
Number of Residues4
Detailsbinding site for residue GOL A 501
ChainResidue
APHE172
ALYS191
AGLU206
AASP325

site_idAC2
Number of Residues4
Detailsbinding site for residue GOL A 502
ChainResidue
ACYS151
AGLU169
ALYS174
ALYS194

site_idAC3
Number of Residues10
Detailsbinding site for residue H3H A 503
ChainResidue
AGLY168
AGLU169
AALA189
ALYS191
AGLU242
ALEU244
AGLY245
AASP250
ALEU295
ALEU167

site_idAC4
Number of Residues3
Detailsbinding site for residue GOL B 501
ChainResidue
BSER220
BARG223
BLYS322

site_idAC5
Number of Residues4
Detailsbinding site for residue GOL B 502
ChainResidue
BLYS191
BALA202
BGLU206
BASP325

site_idAC6
Number of Residues4
Detailsbinding site for residue GOL B 503
ChainResidue
BGLU169
BLYS174
BLYS194
BHOH601

site_idAC7
Number of Residues9
Detailsbinding site for residue H3H B 504
ChainResidue
BLEU167
BGLY168
BGLU169
BALA189
BLYS191
BGLU242
BLEU244
BGLY245
BLEU295

site_idAC8
Number of Residues5
Detailsbinding site for residue PO4 C 501
ChainResidue
AHIS335
ATHR338
CHIS335
CSER337
CTHR338

site_idAC9
Number of Residues4
Detailsbinding site for residue GOL C 502
ChainResidue
CMET0
CGLU169
CLYS174
CHOH671

site_idAD1
Number of Residues7
Detailsbinding site for residue GOL C 503
ChainResidue
CPHE172
CLYS191
CALA202
CALA203
CGLU206
CASP325
CGLY327

site_idAD2
Number of Residues9
Detailsbinding site for residue H3H C 504
ChainResidue
CLEU167
CGLY168
CGLU169
CALA189
CLYS191
CGLU242
CLEU244
CGLY245
CLEU295

Functional Information from PROSITE/UniProt
site_idPS00107
Number of Residues25
DetailsPROTEIN_KINASE_ATP Protein kinases ATP-binding region signature. LGEGAFGKVVeCidhkaggrh.........VAVK
ChainResidueDetails
ALEU167-LYS191

site_idPS00108
Number of Residues13
DetailsPROTEIN_KINASE_ST Serine/Threonine protein kinases active-site signature. LtHtDLKpeNILF
ChainResidueDetails
ALEU284-PHE296

Functional Information from SwissProt/UniProt
site_idSWS_FT_FI1
Number of Residues3
DetailsACT_SITE: Proton acceptor => ECO:0000255|PROSITE-ProRule:PRU00159, ECO:0000255|PROSITE-ProRule:PRU10027
ChainResidueDetails
AASP288
BASP288
CASP288

site_idSWS_FT_FI2
Number of Residues6
DetailsBINDING: BINDING => ECO:0000255|PROSITE-ProRule:PRU00159
ChainResidueDetails
BLYS191
CLEU167
CLYS191
ALEU167
ALYS191
BLEU167

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PDB entries from 2024-06-12

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