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3SH2

Staphylococcus aureus Dihydrofolate Reductase complexed with NADPH and 6-ethyl-5-(3-(4-methoxybiphenyl-3-yl)prop-1-ynyl)pyrimidine-2,4-diamine (UCP120J)

Functional Information from GO Data
ChainGOidnamespacecontents
A0004146molecular_functiondihydrofolate reductase activity
A0006730biological_processone-carbon metabolic process
A0016491molecular_functionoxidoreductase activity
A0046654biological_processtetrahydrofolate biosynthetic process
A0050661molecular_functionNADP binding
B0004146molecular_functiondihydrofolate reductase activity
B0006730biological_processone-carbon metabolic process
B0016491molecular_functionoxidoreductase activity
B0046654biological_processtetrahydrofolate biosynthetic process
B0050661molecular_functionNADP binding
Functional Information from PDB Data
site_idAC1
Number of Residues23
DetailsBINDING SITE FOR RESIDUE NDP A 207
ChainResidue
AVAL6
ALYS45
ATHR46
ALEU62
ATHR63
ASER64
AHIS77
APHE92
AGLY94
AGLN95
ATHR96
AALA7
ALEU97
AGLU100
ATHR121
A5DR168
AILE14
AGLY15
AASN18
AGLN19
ALEU20
AGLY43
AARG44

site_idAC2
Number of Residues23
DetailsBINDING SITE FOR RESIDUE NDP B 207
ChainResidue
BVAL6
BALA7
BILE14
BGLY15
BASN18
BGLN19
BLEU20
BGLY43
BARG44
BLYS45
BTHR46
BLEU62
BTHR63
BSER64
BHIS77
BPHE92
BGLY94
BGLN95
BTHR96
BLEU97
BGLU100
BTHR121
B5DR168

site_idAC3
Number of Residues12
DetailsBINDING SITE FOR RESIDUE 5DR A 168
ChainResidue
ALEU5
AVAL6
AALA7
ALEU20
AASP27
ALEU28
AVAL31
ASER49
AILE50
APHE92
ATHR111
ANDP207

site_idAC4
Number of Residues10
DetailsBINDING SITE FOR RESIDUE 5DR B 168
ChainResidue
BLEU5
BVAL6
BALA7
BASP27
BLEU28
BVAL31
BILE50
BPHE92
BTHR111
BNDP207

Functional Information from PROSITE/UniProt
site_idPS00075
Number of Residues23
DetailsDHFR_1 Dihydrofolate reductase (DHFR) domain signature. VIGfenqLPWhlpn.DlkhVkklS
ChainResidueDetails
AVAL13-SER35

Functional Information from SwissProt/UniProt
site_idSWS_FT_FI1
Number of Residues10
DetailsBINDING: BINDING => ECO:0000305|PubMed:19280600
ChainResidueDetails
ALEU5
BPHE92
AASP27
ASER49
AARG57
APHE92
BLEU5
BASP27
BSER49
BARG57

site_idSWS_FT_FI2
Number of Residues12
DetailsBINDING: BINDING => ECO:0000269|PubMed:19280600
ChainResidueDetails
AVAL6
BLEU62
BGLU100
BTHR121
AILE14
AGLY43
ALEU62
AGLU100
ATHR121
BVAL6
BILE14
BGLY43

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PDB entries from 2024-07-24

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