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5CJN

Crystal structure of Mycobacterium tuberculosis malate synthase in complex with 3-(3-oxo-3,4-dihydroquinoxalin-2-yl)acrylate

Functional Information from GO Data
ChainGOidnamespacecontents
A0000287molecular_functionmagnesium ion binding
A0001968molecular_functionfibronectin binding
A0003824molecular_functioncatalytic activity
A0004474molecular_functionmalate synthase activity
A0005515molecular_functionprotein binding
A0005518molecular_functioncollagen binding
A0005576cellular_componentextracellular region
A0005737cellular_componentcytoplasm
A0005829cellular_componentcytosol
A0005886cellular_componentplasma membrane
A0006097biological_processglyoxylate cycle
A0006099biological_processtricarboxylic acid cycle
A0009274cellular_componentpeptidoglycan-based cell wall
A0009436biological_processglyoxylate catabolic process
A0009986cellular_componentcell surface
A0015936biological_processcoenzyme A metabolic process
A0016740molecular_functiontransferase activity
A0042603cellular_componentcapsule
A0042803molecular_functionprotein homodimerization activity
A0043236molecular_functionlaminin binding
A0044406biological_processadhesion of symbiont to host
A0046810molecular_functionhost cell extracellular matrix binding
A0046872molecular_functionmetal ion binding
A0120225molecular_functioncoenzyme A binding
Functional Information from PDB Data
site_idAC1
Number of Residues7
Detailsbinding site for residue MG A 801
ChainResidue
AMET432
AGLU434
AASP462
AHOH912
AHOH1030
AHOH1059
AHOH1242

site_idAC2
Number of Residues2
Detailsbinding site for residue MG A 802
ChainResidue
AHOH1310
AHOH1318

site_idAC3
Number of Residues8
Detailsbinding site for residue MG A 803
ChainResidue
AASN295
ALYS296
AHIS374
ALYS377
AASN382
AGLY383
APRO384
ALEU385

site_idAC4
Number of Residues3
Detailsbinding site for residue MG A 804
ChainResidue
AGLN564
AHOH958
AHOH1135

site_idAC5
Number of Residues1
Detailsbinding site for residue MG A 805
ChainResidue
AGLY222

site_idAC6
Number of Residues5
Detailsbinding site for residue MG A 806
ChainResidue
ALYS443
AHOH1124
AHOH1185
AHOH1339
AHOH1357

site_idAC7
Number of Residues3
Detailsbinding site for residue MG A 807
ChainResidue
AHOH1155
AHOH1265
AHOH1402

site_idAC8
Number of Residues5
Detailsbinding site for residue MG A 808
ChainResidue
AHIS235
AHOH928
AHOH1140
AHOH1182
AHOH1293

site_idAC9
Number of Residues15
Detailsbinding site for residue 52F A 809
ChainResidue
AVAL118
ASER275
APHE460
ALEU461
AASP462
AMET515
ATHR517
AMET631
AGLU632
AASP633
AHOH908
AHOH912
AHOH946
AHOH1138
AHOH1231

Functional Information from SwissProt/UniProt
site_idSWS_FT_FI1
Number of Residues1
DetailsACT_SITE: Proton acceptor
ChainResidueDetails
AARG339

site_idSWS_FT_FI2
Number of Residues1
DetailsACT_SITE: Proton donor
ChainResidueDetails
AASP633

site_idSWS_FT_FI3
Number of Residues12
DetailsBINDING:
ChainResidueDetails
ASER275
ALYS305
AARG312
AARG339
AGLU434
AGLY459
AASP462
APRO543
AGLY618
AASP633
AVAL118
AARG125

site_idSWS_FT_FI4
Number of Residues1
DetailsMOD_RES: Cysteine sulfenic acid (-SOH) => ECO:0000255|HAMAP-Rule:MF_00641
ChainResidueDetails
AALA619

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PDB entries from 2024-06-12

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