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4Y6G

Crystal structure of Tryptophan Synthase from Salmonella typhimurium in complex with N-(4'-trifluoromethoxybenzoyl)-2-amino-1-ethylphosphate (F6F) inhibitor in the alpha-site and beta-site.

Functional Information from GO Data
ChainGOidnamespacecontents
A0000162biological_processtryptophan biosynthetic process
A0004834molecular_functiontryptophan synthase activity
A0005515molecular_functionprotein binding
A0005829cellular_componentcytosol
A0006568biological_processtryptophan metabolic process
A0016829molecular_functionlyase activity
B0000162biological_processtryptophan biosynthetic process
B0004834molecular_functiontryptophan synthase activity
B0005515molecular_functionprotein binding
B0005737cellular_componentcytoplasm
B0006568biological_processtryptophan metabolic process
B0016829molecular_functionlyase activity
B0042802molecular_functionidentical protein binding
Functional Information from PDB Data
site_idAC1
Number of Residues17
Detailsbinding site for residue F6F A 301
ChainResidue
AGLU49
APHE212
AGLY213
AGLY234
ASER235
AHOH469
AHOH501
AHOH596
BPRO18
AALA59
AASP60
AILE64
ALEU100
ALEU127
AALA129
AILE153
ATYR175

site_idAC2
Number of Residues19
Detailsbinding site for residue PLP B 401
ChainResidue
BHIS86
BLYS87
BGLN114
BTHR190
BCYS230
BGLY232
BGLY233
BGLY234
BSER235
BASN236
BGLY303
BGLU350
BSER377
BGLY378
BF6F402
BHOH616
BHOH723
BHOH778
BHOH965

site_idAC3
Number of Residues20
Detailsbinding site for residue F6F B 402
ChainResidue
BLYS87
BGLU109
BTHR110
BGLY111
BALA112
BGLY113
BGLN114
BHIS115
BCYS170
BLEU174
BTYR186
BLEU188
BTHR190
BGLY193
BPHE280
BPHE306
BPLP401
BHOH717
BHOH892
BHOH965

site_idAC4
Number of Residues5
Detailsbinding site for residue NA B 403
ChainResidue
BGLY232
BPHE306
BSER308
BHOH921
BHOH922

Functional Information from PROSITE/UniProt
site_idPS00167
Number of Residues14
DetailsTRP_SYNTHASE_ALPHA Tryptophan synthase alpha chain signature. LELGvPFSDPLADG
ChainResidueDetails
ALEU48-GLY61

site_idPS00168
Number of Residues15
DetailsTRP_SYNTHASE_BETA Tryptophan synthase beta chain pyridoxal-phosphate attachment site. LlHgGAHKtNqvLgQ
ChainResidueDetails
BLEU80-GLN94

Functional Information from SwissProt/UniProt
site_idSWS_FT_FI1
Number of Residues1
DetailsMOD_RES: N6-(pyridoxal phosphate)lysine
ChainResidueDetails
BLYS87
AASP60

Catalytic Information from CSA
site_idMCSA1
Number of Residues3
DetailsM-CSA 383
ChainResidueDetails
BLYS87electron pair acceptor, electron pair donor, nucleofuge, nucleophile, proton acceptor, proton donor
BGLU109
BSER377hydrogen bond donor

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PDB entries from 2024-11-06

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