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5U26

Crystal Structure of Mycobacterium tuberculosis Dihydrofolate Reductase Bound to NADP and p218 Inhibitor

Functional Information from GO Data
ChainGOidnamespacecontents
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
A0070401molecular_functionNADP+ binding
Functional Information from PDB Data
site_idAC1
Number of Residues13
Detailsbinding site for residue MMV A 201
ChainResidue
AILE5
ATYR100
ANAP202
AHOH305
AHOH374
ATRP6
AASP27
APHE31
AARG32
ALEU50
ALEU57
AARG60
AILE94

site_idAC2
Number of Residues35
Detailsbinding site for residue NAP A 202
ChainResidue
ATRP6
AALA7
AILE14
AGLY15
AARG16
AGLY18
AASP19
AILE20
AGLY43
AARG44
AARG45
ATHR46
ASER49
ALEU65
ASER66
AARG67
AGLN68
AGLY80
AILE94
AGLY96
AGLY97
AGLN98
AVAL99
ATYR100
ALEU102
AMMV201
AEDO203
ASO4204
AHOH301
AHOH320
AHOH321
AHOH322
AHOH331
AHOH344
AHOH384

site_idAC3
Number of Residues6
Detailsbinding site for residue EDO A 203
ChainResidue
AARG16
AGLY17
AGLY18
AGLY124
ANAP202
AHOH306

site_idAC4
Number of Residues6
Detailsbinding site for residue SO4 A 204
ChainResidue
APRO58
AGLY59
ASER81
ALEU82
ANAP202
AHOH321

site_idAC5
Number of Residues2
Detailsbinding site for residue SO4 A 205
ChainResidue
AARG44
AARG45

Functional Information from PROSITE/UniProt
site_idPS00075
Number of Residues23
DetailsDHFR_1 Dihydrofolate reductase (DHFR) domain signature. VIGrggdIPWrlpe.DqahFreiT
ChainResidueDetails
AVAL13-THR35

Functional Information from SwissProt/UniProt
site_idSWS_FT_FI1
Number of Residues12
DetailsBINDING:
ChainResidueDetails
AILE5
AILE94
ATYR100
ATHR113
ATRP6
AILE14
AASP27
AARG32
AGLY43
AARG60
ALEU65
AGLY80

222036

PDB entries from 2024-07-03

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