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4NIL

Crystal structure of B. anthracis DHPS with compound 5: 4-[(trifluoromethyl)sulfanyl]benzamide

Functional Information from GO Data
ChainGOidnamespacecontents
A0004156molecular_functiondihydropteroate synthase activity
A0005829cellular_componentcytosol
A0009396biological_processfolic acid-containing compound biosynthetic process
A0016740molecular_functiontransferase activity
A0042558biological_processpteridine-containing compound metabolic process
A0044237biological_processcellular metabolic process
A0046654biological_processtetrahydrofolate biosynthetic process
A0046656biological_processfolic acid biosynthetic process
A0046872molecular_functionmetal ion binding
B0004156molecular_functiondihydropteroate synthase activity
B0005829cellular_componentcytosol
B0009396biological_processfolic acid-containing compound biosynthetic process
B0016740molecular_functiontransferase activity
B0042558biological_processpteridine-containing compound metabolic process
B0044237biological_processcellular metabolic process
B0046654biological_processtetrahydrofolate biosynthetic process
B0046656biological_processfolic acid biosynthetic process
B0046872molecular_functionmetal ion binding
Functional Information from PDB Data
site_idAC1
Number of Residues6
DetailsBINDING SITE FOR RESIDUE SO4 A 301
ChainResidue
AILE25
AASN27
AARG68
APRO69
AARG254
AHIS256

site_idAC2
Number of Residues3
DetailsBINDING SITE FOR RESIDUE SO4 A 302
ChainResidue
ALYS50
AARG53
AGLU93

site_idAC3
Number of Residues2
DetailsBINDING SITE FOR RESIDUE SO4 A 303
ChainResidue
ASER221
AARG234

site_idAC4
Number of Residues1
DetailsBINDING SITE FOR RESIDUE SO4 A 304
ChainResidue
AARG219

site_idAC5
Number of Residues1
DetailsBINDING SITE FOR RESIDUE SO4 A 305
ChainResidue
AARG263

site_idAC6
Number of Residues6
DetailsBINDING SITE FOR RESIDUE 2O8 A 306
ChainResidue
ALEU235
ALEU235
AGLU236
AGLU236
AMET264
AMET264

site_idAC7
Number of Residues2
DetailsBINDING SITE FOR RESIDUE SO4 B 301
ChainResidue
BLEU229
BARG263

site_idAC8
Number of Residues2
DetailsBINDING SITE FOR RESIDUE SO4 B 302
ChainResidue
BSER221
BARG234

site_idAC9
Number of Residues2
DetailsBINDING SITE FOR RESIDUE SO4 B 303
ChainResidue
BLYS50
BARG53

site_idBC1
Number of Residues2
DetailsBINDING SITE FOR RESIDUE SO4 B 304
ChainResidue
BASN27
BARG219

site_idBC2
Number of Residues2
DetailsBINDING SITE FOR RESIDUE SO4 B 305
ChainResidue
BARG201
BASN202

site_idBC3
Number of Residues3
DetailsBINDING SITE FOR RESIDUE SO4 B 306
ChainResidue
BILE25
BARG254
BHIS256

site_idBC4
Number of Residues7
DetailsBINDING SITE FOR RESIDUE 2O8 B 307
ChainResidue
BLEU235
BLEU235
BGLU236
BGLU236
BGLU260
BMET264
BMET264

Functional Information from PROSITE/UniProt
site_idPS00792
Number of Residues16
DetailsDHPS_1 Dihydropteroate synthase signature 1. ImGILNvTpDSFsDgG
ChainResidueDetails
AILE22-GLY37

site_idPS00793
Number of Residues14
DetailsDHPS_2 Dihydropteroate synthase signature 2. GAhIIDIGGesTrP
ChainResidueDetails
AGLY56-PRO69

221371

PDB entries from 2024-06-19

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