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4MUF

Crystal structure of pantothenate synthetase in complex with 2-(2-(4-tert-butylphenylsulfonylcarbamoyl)-5-methoxy-1H-indol-1-yl)acetic acid

Functional Information from GO Data
ChainGOidnamespacecontents
A0000166molecular_functionnucleotide binding
A0004592molecular_functionpantoate-beta-alanine ligase activity
A0005524molecular_functionATP binding
A0005737cellular_componentcytoplasm
A0005829cellular_componentcytosol
A0015940biological_processpantothenate biosynthetic process
A0016874molecular_functionligase activity
A0046872molecular_functionmetal ion binding
B0000166molecular_functionnucleotide binding
B0004592molecular_functionpantoate-beta-alanine ligase activity
B0005524molecular_functionATP binding
B0005737cellular_componentcytoplasm
B0005829cellular_componentcytosol
B0015940biological_processpantothenate biosynthetic process
B0016874molecular_functionligase activity
B0046872molecular_functionmetal ion binding
Functional Information from PDB Data
site_idAC1
Number of Residues5
DetailsBINDING SITE FOR RESIDUE EOH A 401
ChainResidue
ALEU114
AARG115
ATHR117
BGLN119
BPRO120

site_idAC2
Number of Residues2
DetailsBINDING SITE FOR RESIDUE EOH A 402
ChainResidue
ATHR218
BHIS222

site_idAC3
Number of Residues21
DetailsBINDING SITE FOR RESIDUE 2DJ A 403
ChainResidue
AMET40
AHIS44
AGLY46
AHIS47
AGLN72
ATYR82
AVAL139
AVAL143
APHE157
AGLY158
ALYS160
AASP161
AGLN164
AVAL184
APRO185
AVAL187
AMET195
ASER196
ASER197
APRO38
ATHR39

site_idAC4
Number of Residues12
DetailsBINDING SITE FOR RESIDUE 2DJ B 401
ChainResidue
BMET40
BHIS44
BGLY46
BHIS47
BGLY158
BGLN164
BPRO185
BVAL187
BMET195
BSER196
BSER197
BHOH533

site_idAC5
Number of Residues3
DetailsBINDING SITE FOR RESIDUE EOH B 402
ChainResidue
APRO17
AALA21
BASN176

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

246704

PDB entries from 2025-12-24

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