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7K69

Crystal Structure of Dihydrofolate reductase (DHFR) from Mycobacterium ulcerans Agy99 in complex with NADP and inhibitor SDDC-0001574

Functional Information from GO Data
ChainGOidnamespacecontents
A0000166molecular_functionnucleotide binding
A0004146molecular_functiondihydrofolate reductase activity
A0005829cellular_componentcytosol
A0006730biological_processone-carbon metabolic process
A0016491molecular_functionoxidoreductase activity
A0046452biological_processdihydrofolate metabolic process
A0046654biological_processtetrahydrofolate biosynthetic process
A0046655biological_processfolic acid metabolic process
A0050661molecular_functionNADP binding
Functional Information from PDB Data
site_idAC1
Number of Residues37
Detailsbinding site for residue NAP A 201
ChainResidue
ATRP8
AARG46
AARG47
ATHR48
AVAL67
ATHR68
AARG69
AGLN70
AGLY82
AILE100
AGLY102
AALA9
AALA103
AGLN104
AILE105
ATYR106
ALEU108
AVY7202
AHOH322
AHOH328
AHOH343
AHOH345
AILE16
AHOH350
AHOH367
AHOH372
AHOH386
AHOH389
AHOH397
AHOH406
AHOH412
AGLY17
AARG18
AGLY20
AGLY21
AILE22
AGLY45

site_idAC2
Number of Residues22
Detailsbinding site for residue VY7 A 202
ChainResidue
AILE7
ATRP8
AALA9
AILE22
ALEU26
AASP29
ALEU30
APHE33
ALYS34
APRO53
AHIS56
ALEU59
AARG62
AILE100
ATYR106
ANAP201
AHOH301
AHOH304
AHOH314
AHOH327
AHOH380
AHOH401

site_idAC3
Number of Residues3
Detailsbinding site for residue SER A 203
ChainResidue
AGLU120
AHIS160
ATYR162

Functional Information from PROSITE/UniProt
site_idPS00075
Number of Residues23
DetailsDHFR_1 Dihydrofolate reductase (DHFR) domain signature. VIGrdggIPWrlpe.DlahFkrlT
ChainResidueDetails
AVAL15-THR37

225158

PDB entries from 2024-09-18

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