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6UWW

Crystal structure of dihydrofolate reductase from Mycobacterium ulcerans with P218 inhibitor

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 Residues16
Detailsbinding site for residue MMV A 301
ChainResidue
AILE15
ALEU67
AARG70
AILE108
ATYR114
ANAP304
AHOH536
AHOH544
ATRP16
AILE30
AASP37
ALEU38
APHE41
ALYS42
APRO61
AHIS64

site_idAC2
Number of Residues5
Detailsbinding site for residue SO4 A 302
ChainResidue
ATRP32
AARG33
ALEU34
AHOH403
AHOH501

site_idAC3
Number of Residues3
Detailsbinding site for residue SO4 A 303
ChainResidue
AHIS168
ATYR170
AHOH402

site_idAC4
Number of Residues36
Detailsbinding site for residue NAP A 304
ChainResidue
ATRP16
AALA17
AILE24
AGLY25
AARG26
AGLY29
AGLY53
AARG54
AARG55
ATHR56
ASER59
AVAL75
ATHR76
AARG77
AGLN78
AGLY90
AILE108
AGLY110
AALA111
AGLN112
AILE113
ATYR114
AMMV301
AHOH407
AHOH438
AHOH460
AHOH482
AHOH498
AHOH510
AHOH512
AHOH518
AHOH520
AHOH523
AHOH533
AHOH559
AHOH579

Functional Information from PROSITE/UniProt
site_idPS00075
Number of Residues23
DetailsDHFR_1 Dihydrofolate reductase (DHFR) domain signature. VIGrdggIPWrlpe.DlahFkrlT
ChainResidueDetails
AVAL23-THR45

226707

PDB entries from 2024-10-30

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