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6BU1

Crystal structure of Mycobacterium tuberculosis malate synthase in complex with 2-Br-3-OH-phenyldiketoacid

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 Residues5
Detailsbinding site for residue MG A 801
ChainResidue
AGLU434
AASP462
AE9S805
AHOH966
AHOH1019

site_idAC2
Number of Residues3
Detailsbinding site for residue MG A 802
ChainResidue
AARG479
ATHR482
ATRP589

site_idAC3
Number of Residues6
Detailsbinding site for residue MG A 803
ChainResidue
AHOH1136
AHOH1168
AHOH1340
AHOH1358
AHOH1526
AHIS235

site_idAC4
Number of Residues6
Detailsbinding site for residue MG A 804
ChainResidue
AHOH1018
AHOH1132
AHOH1234
AHOH1399
AHOH1402
AHOH1408

site_idAC5
Number of Residues17
Detailsbinding site for residue E9S A 805
ChainResidue
AVAL118
AARG339
AGLU434
AGLY459
APHE460
ALEU461
AASP462
ATRP541
AMET631
AASP633
AALA635
AMG801
AHOH904
AHOH966
AHOH1019
AHOH1185
AHOH1352

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
AVAL118
ALYS305
AGLY618
AASP633
AARG125
ASER275
AARG312
AARG339
AGLU434
AGLY459
AASP462
APRO543

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 2024-07-17

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