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4MUE

Crystal strcture of pantothenate synthetase in complex with 2-(5-methoxy-2-(4-(trifluoromethyl)phenylsulfonylcarbamoyl)-1H-indol-1-yl)acetic acid

Functional Information from GO Data
ChainGOidnamespacecontents
A0004592molecular_functionpantoate-beta-alanine ligase activity
A0015940biological_processpantothenate biosynthetic process
B0004592molecular_functionpantoate-beta-alanine ligase activity
B0015940biological_processpantothenate biosynthetic process
Functional Information from PDB Data
site_idAC1
Number of Residues19
DetailsBINDING SITE FOR RESIDUE 2DH A 401
ChainResidue
APRO38
ALYS160
AASP161
AGLN164
AILE168
APRO185
ATHR186
AVAL187
AMET195
ASER196
ASER197
ATHR39
AMET40
AHIS44
AGLY46
AHIS47
AVAL139
AVAL143
APHE157

site_idAC2
Number of Residues14
DetailsBINDING SITE FOR RESIDUE 2DH A 402
ChainResidue
ALEU114
ATHR117
APRO133
ATHR134
AALA137
AGLY138
BILE3
BPRO4
BPHE6
BPRO8
BLEU27
BTHR30
BARG32
BGLN119

site_idAC3
Number of Residues2
DetailsBINDING SITE FOR RESIDUE EOH A 403
ChainResidue
APHE67
AHOH501

site_idAC4
Number of Residues2
DetailsBINDING SITE FOR RESIDUE EOH A 404
ChainResidue
ATHR103
ATHR105

site_idAC5
Number of Residues15
DetailsBINDING SITE FOR RESIDUE 2DH B 401
ChainResidue
BPRO38
BTHR39
BMET40
BHIS44
BGLY46
BHIS47
BVAL139
BVAL143
BPHE157
BGLN164
BPRO185
BVAL187
BMET195
BSER196
BSER197

site_idAC6
Number of Residues5
DetailsBINDING SITE FOR RESIDUE EDO B 402
ChainResidue
BGLY244
BALA246
BARG273
BLEU274
BGLY275

site_idAC7
Number of Residues7
DetailsBINDING SITE FOR RESIDUE EDO B 403
ChainResidue
AGLN148
AARG151
BLEU147
BGLN148
BASP178
BHOH526
BHOH585

Functional Information from SwissProt/UniProt
site_idSWS_FT_FI1
Number of Residues2
DetailsActive site: {"description":"Proton donor"}
ChainResidueDetails

site_idSWS_FT_FI2
Number of Residues28
DetailsBinding site: {"evidences":[{"source":"PubMed","id":"16460002","evidenceCode":"ECO:0000269"}]}
ChainResidueDetails

site_idSWS_FT_FI3
Number of Residues9
DetailsBinding site: {}
ChainResidueDetails

site_idSWS_FT_FI4
Number of Residues1
DetailsModified residue: {"description":"N-acetylthreonine","evidences":[{"source":"PubMed","id":"21969609","evidenceCode":"ECO:0007744"}]}
ChainResidueDetails

238582

PDB entries from 2025-07-09

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