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4CAE

Plasmodium vivax N-myristoyltransferase in complex with a benzothiophene inhibitor (compound 20b)

Functional Information from GO Data
ChainGOidnamespacecontents
A0004379molecular_functionglycylpeptide N-tetradecanoyltransferase activity
A0006499biological_processN-terminal protein myristoylation
A0016746molecular_functionacyltransferase activity
A0046872molecular_functionmetal ion binding
B0004379molecular_functionglycylpeptide N-tetradecanoyltransferase activity
B0006499biological_processN-terminal protein myristoylation
B0016746molecular_functionacyltransferase activity
B0046872molecular_functionmetal ion binding
C0004379molecular_functionglycylpeptide N-tetradecanoyltransferase activity
C0006499biological_processN-terminal protein myristoylation
C0016746molecular_functionacyltransferase activity
C0046872molecular_functionmetal ion binding
Functional Information from PDB Data
site_idAC1
Number of Residues39
DetailsBINDING SITE FOR RESIDUE NHW A 1422
ChainResidue
ATYR28
ALEU163
ACYS164
AVAL165
AARG170
ASER171
ALYS172
AARG173
ALEU174
AALA175
APRO176
ALYS29
ATHR183
AILE186
AASN187
ATRP192
AGLN193
AALA194
ATYR196
ATHR197
ALEU202
ATYR393
APHE30
AMG1411
AHOH2001
AHOH2002
AHOH2226
AHOH2235
AHOH2432
AHOH2433
AHOH2435
AHOH2436
AHOH2437
ATRP31
AASN94
ATYR95
AVAL96
AASN161
APHE162

site_idAC2
Number of Residues41
DetailsBINDING SITE FOR RESIDUE NHW B 1422
ChainResidue
BTYR28
BLYS29
BPHE30
BTRP31
BASN94
BTYR95
BVAL96
BASN161
BPHE162
BLEU163
BCYS164
BVAL165
BARG170
BSER171
BLYS172
BARG173
BLEU174
BALA175
BPRO176
BTHR183
BILE186
BASN187
BTRP192
BGLN193
BALA194
BTYR196
BTHR197
BLEU202
BTYR393
BMG1412
BHOH2002
BHOH2004
BHOH2221
BHOH2226
BHOH2227
BHOH2448
BHOH2449
BHOH2450
BHOH2451
BHOH2452
BHOH2453

site_idAC3
Number of Residues37
DetailsBINDING SITE FOR RESIDUE NHW C 1422
ChainResidue
CTHR183
CILE186
CTRP192
CGLN193
CTYR196
CTHR197
CLEU202
CTYR393
CMG1411
CHOH2002
CHOH2200
CHOH2205
CHOH2396
CHOH2397
CHOH2398
CHOH2399
CHOH2400
CHOH2401
CTYR28
CLYS29
CPHE30
CTRP31
CASN94
CTYR95
CVAL96
CASN161
CPHE162
CLEU163
CCYS164
CVAL165
CARG170
CSER171
CLYS172
CARG173
CLEU174
CALA175
CPRO176

site_idAC4
Number of Residues5
DetailsBINDING SITE FOR RESIDUE SO4 B 1411
ChainResidue
AARG210
ALYS373
BARG210
BLYS373
BHOH2446

site_idAC5
Number of Residues6
DetailsBINDING SITE FOR RESIDUE MG A 1411
ChainResidue
ALEU169
ASER171
ALYS172
AARG173
ALEU174
ANHW1422

site_idAC6
Number of Residues6
DetailsBINDING SITE FOR RESIDUE MG B 1412
ChainResidue
BLEU169
BSER171
BLYS172
BARG173
BLEU174
BNHW1422

site_idAC7
Number of Residues6
DetailsBINDING SITE FOR RESIDUE MG C 1411
ChainResidue
CLEU169
CSER171
CLYS172
CARG173
CLEU174
CNHW1422

site_idAC8
Number of Residues2
DetailsBINDING SITE FOR RESIDUE CL A 1412
ChainResidue
ASER328
ATHR329

site_idAC9
Number of Residues5
DetailsBINDING SITE FOR RESIDUE CL A 1413
ChainResidue
ALYS180
ATHR247
ALEU248
AARG358
AHOH2058

site_idBC1
Number of Residues4
DetailsBINDING SITE FOR RESIDUE CL C 1412
ChainResidue
CLYS180
CTHR247
CLEU248
CARG358

site_idBC2
Number of Residues5
DetailsBINDING SITE FOR RESIDUE CL B 1413
ChainResidue
BLYS180
BTHR247
BLEU248
BARG358
BHOH2312

site_idBC3
Number of Residues22
DetailsBINDING SITE FOR RESIDUE 3F3 B 1414
ChainResidue
BVAL96
BGLU97
BASP98
BPHE103
BPHE105
BTYR107
BTHR197
BTYR211
BTYR315
BSER319
BTYR334
BSER335
BASN365
BALA366
BLEU367
BLEU388
BLEU409
BLEU410
BHOH2130
BHOH2215
BHOH2241
BHOH2447

site_idBC4
Number of Residues18
DetailsBINDING SITE FOR RESIDUE 3F3 A 1414
ChainResidue
AVAL96
AGLU97
AASP98
APHE103
APHE105
ATYR107
ATHR197
ATYR211
ATYR315
ASER319
ATYR334
ASER335
AASN365
ALEU367
ALEU388
ALEU409
ALEU410
AHOH2431

site_idBC5
Number of Residues21
DetailsBINDING SITE FOR RESIDUE 3F3 C 1413
ChainResidue
CVAL96
CGLU97
CASP98
CPHE103
CPHE105
CTYR107
CTHR197
CTYR211
CPHE226
CTYR315
CSER319
CTYR334
CSER335
CASN365
CALA366
CLEU367
CLEU409
CLEU410
CHOH2218
CHOH2394
CHOH2395

site_idBC6
Number of Residues4
DetailsBINDING SITE FOR RESIDUE DMS A 1415
ChainResidue
AGLU159
APHE281
ATRP289
AHOH2379

site_idBC7
Number of Residues3
DetailsBINDING SITE FOR RESIDUE DMS B 1415
ChainResidue
BGLU159
BTRP289
BHOH2396

site_idBC8
Number of Residues4
DetailsBINDING SITE FOR RESIDUE DMS C 1414
ChainResidue
CGLU159
CPHE281
CTRP289
CHOH2345

Functional Information from PROSITE/UniProt
site_idPS00975
Number of Residues9
DetailsNMT_1 Myristoyl-CoA:protein N-myristoyltransferase signature 1. EVNFLCvHK
ChainResidueDetails
AGLU159-LYS167

site_idPS00976
Number of Residues7
DetailsNMT_2 Myristoyl-CoA:protein N-myristoyltransferase signature 2. KFGeGDG
ChainResidueDetails
ALYS380-GLY386

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PDB entries from 2024-07-24

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