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5KGG

Crystal structure of PIM1 with inhibitor: 2-(5-chloranyl-1~{H}-indol-3-yl)ethanamine

Functional Information from GO Data
ChainGOidnamespacecontents
A0004672molecular_functionprotein kinase activity
A0004674molecular_functionprotein serine/threonine kinase activity
A0005524molecular_functionATP binding
A0006468biological_processprotein phosphorylation
A0043066biological_processnegative regulation of apoptotic process
Functional Information from PDB Data
site_idAC1
Number of Residues4
Detailsbinding site for residue CL A 401
ChainResidue
ALYS67
AASP186
A6SO423
AHOH525

site_idAC2
Number of Residues5
Detailsbinding site for residue EDO A 402
ChainResidue
AILE133
AASP170
AASP234
AGLY238
AEDO409

site_idAC3
Number of Residues5
Detailsbinding site for residue EDO A 403
ChainResidue
AASP128
ALEU174
A6SO423
AHOH540
AHOH545

site_idAC4
Number of Residues6
Detailsbinding site for residue EDO A 404
ChainResidue
AARG136
AALA138
ALEU139
AGLN140
ALEU143
AHOH563

site_idAC5
Number of Residues5
Detailsbinding site for residue EDO A 405
ChainResidue
AARG221
ATHR280
APHE281
AEDO415
AHOH503

site_idAC6
Number of Residues6
Detailsbinding site for residue EDO A 406
ChainResidue
AGLU153
AHIS157
AASN160
AGLN264
AHOH509
AHOH529

site_idAC7
Number of Residues4
Detailsbinding site for residue EDO A 407
ChainResidue
AGLU35
AVAL40
AHOH510
AHOH528

site_idAC8
Number of Residues4
Detailsbinding site for residue EDO A 408
ChainResidue
AASP114
ALEU193
AHOH580
AHOH593

site_idAC9
Number of Residues3
Detailsbinding site for residue EDO A 409
ChainResidue
AASP170
ATYR207
AEDO402

site_idAD1
Number of Residues4
Detailsbinding site for residue EDO A 410
ChainResidue
AARG274
APRO275
ASER276
AHOH519

site_idAD2
Number of Residues3
Detailsbinding site for residue EDO A 411
ChainResidue
ATHR204
AARG205
AHOH664

site_idAD3
Number of Residues3
Detailsbinding site for residue EDO A 412
ChainResidue
AARG179
AARG250
AHOH586

site_idAD4
Number of Residues5
Detailsbinding site for residue EDO A 413
ChainResidue
AGLU262
AHIS265
AHIS287
APRO288
AEDO417

site_idAD5
Number of Residues9
Detailsbinding site for residue EDO A 414
ChainResidue
ATRP149
AARG256
AGLN257
AMET290
AGLN291
AASP292
AVAL293
AHOH522
AHOH585

site_idAD6
Number of Residues7
Detailsbinding site for residue EDO A 415
ChainResidue
ALEU43
AHIS219
AARG221
ASER222
AEDO405
AEDO420
AHOH504

site_idAD7
Number of Residues1
Detailsbinding site for residue EDO A 416
ChainResidue
ALEU177

site_idAD8
Number of Residues8
Detailsbinding site for residue EDO A 417
ChainResidue
ATRP269
AGLU283
AASN286
AHIS287
APRO288
AEDO413
AEDO418
AHOH514

site_idAD9
Number of Residues5
Detailsbinding site for residue EDO A 418
ChainResidue
AHIS265
ATRP269
AEDO417
AHOH559
AHOH576

site_idAE1
Number of Residues6
Detailsbinding site for residue EDO A 419
ChainResidue
AGLU141
AARG258
AVAL259
ASER260
AGLU282
AHOH635

site_idAE2
Number of Residues7
Detailsbinding site for residue EDO A 420
ChainResidue
AHOH581
ATYR53
ALEU193
ALYS194
AGLY220
AARG221
AEDO415

site_idAE3
Number of Residues3
Detailsbinding site for residue EDO A 421
ChainResidue
AGLU141
AGLU142
AARG145

site_idAE4
Number of Residues6
Detailsbinding site for residue EDO A 422
ChainResidue
AASN160
ACYS161
AHIS265
AHOH524
AHOH529
AHOH541

site_idAE5
Number of Residues10
Detailsbinding site for residue 6SO A 423
ChainResidue
AVAL52
AALA65
AARG122
AASP128
ALEU174
AILE185
AASP186
ACL401
AEDO403
AHOH540

site_idAE6
Number of Residues8
Detailsbinding site for residue SO4 A 424
ChainResidue
AARG156
AARG258
ASER261
APHE281
AHOH501
AHOH530
AHOH574
AHOH640

site_idAE7
Number of Residues3
Detailsbinding site for residue SO4 A 425
ChainResidue
AASP108
ATRP109
AHOH549

Functional Information from PROSITE/UniProt
site_idPS00107
Number of Residues24
DetailsPROTEIN_KINASE_ATP Protein kinases ATP-binding region signature. LGSGGFGSVYsGirvsdnlp..........VAIK
ChainResidueDetails
ALEU44-LYS67

site_idPS00108
Number of Residues13
DetailsPROTEIN_KINASE_ST Serine/Threonine protein kinases active-site signature. VlHrDIKdeNILI
ChainResidueDetails
AVAL163-ILE175

Functional Information from SwissProt/UniProt
site_idSWS_FT_FI1
Number of Residues1
DetailsACT_SITE: Proton acceptor => ECO:0000255|PROSITE-ProRule:PRU00159, ECO:0000255|PROSITE-ProRule:PRU10027
ChainResidueDetails
AASP167

site_idSWS_FT_FI2
Number of Residues1
DetailsBINDING: BINDING => ECO:0000255|PROSITE-ProRule:PRU00159
ChainResidueDetails
ALEU44

site_idSWS_FT_FI3
Number of Residues3
DetailsBINDING: BINDING => ECO:0000305|PubMed:15525646, ECO:0000305|PubMed:15657054, ECO:0000305|PubMed:15808862
ChainResidueDetails
AASP128
AGLU121
ALYS67

site_idSWS_FT_FI4
Number of Residues2
DetailsMOD_RES: Phosphoserine => ECO:0000269|PubMed:15657054
ChainResidueDetails
ASER261
ASER98

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PDB entries from 2024-06-12

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