eF-site ID 5ez4-D PDB Code 5ez4 Chain D click to enlarge Title 2.11 Angstrom resolution crystal structure of betaine aldehyde dehydrogenase (betB) P449M/Y450L double mutant from Staphylococcus aureus in complex with NAD+ and BME-modified Cys289 Classification OXIDOREDUCTASE Compound Betaine aldehyde dehydrogenase Source Staphylococcus aureus (Q9L4P8_STAAU) Sequence D:  LKHLSQRQYIDGEWVESANKNTRDIINPYNQEVIFTVSEG TKEDAERAILAARRAFESGEWSQETAETRGKKVRAIADKI KEHREALARLETLDTGKTLEESYADMDDIHNVFMYFAGLA DKDGGEMIDSPIPDTESKIVKEPVGVVTQITPWNYPLLQA SWKIAPALATGCSLVMKPSEITPLTTIRVFELMEEVGFPK GTINLILGAGSEVGDVMSGHKEVDLVSFTGGIETGKHIMK NAANNVTNIALELGGKNPNIIFDDADFELAVDQALNGGYF HAGQVXSAGSRILVQNSIKDKFEQALIDRVKKIKLGNGFD ADTEMGPVISTEHRNKIESYMDVAKAEGATIAVGGKRPDR DDLKDGLFFEPTVITNCDTSMRIVQEEVFGPVVTVEGFET EQEAIQLANDSIYGLAGAVFSKDIGKAQRVANKLKLGTVW INDFHMLFAQAPWGGYKQSGIGRELGKEGLEEYLVSKHIL TNTNPQLVNWFSK Description Functional site 1) chain D residue 249 type sequence V description binding site for residue NA C 502 source : AD3 2) chain D residue 247 type sequence N description binding site for residue PGE C 504 source : AD5 3) chain D residue 103 type sequence E description binding site for residue EPE C 505 source : AD6 4) chain D residue 324 type sequence A description binding site for residue EPE C 505 source : AD6 5) chain D residue 326 type sequence T description binding site for residue EPE C 505 source : AD6 6) chain D residue 153 type sequence I description binding site for residue NAD D 501 source : AD7 7) chain D residue 154 type sequence T description binding site for residue NAD D 501 source : AD7 8) chain D residue 155 type sequence P description binding site for residue NAD D 501 source : AD7 9) chain D residue 156 type sequence W description binding site for residue NAD D 501 source : AD7 10) chain D residue 157 type sequence N description binding site for residue NAD D 501 source : AD7 11) chain D residue 162 type sequence Q description binding site for residue NAD D 501 source : AD7 12) chain D residue 180 type sequence K description binding site for residue NAD D 501 source : AD7 13) chain D residue 182 type sequence S description binding site for residue NAD D 501 source : AD7 14) chain D residue 183 type sequence E description binding site for residue NAD D 501 source : AD7 15) chain D residue 213 type sequence G description binding site for residue NAD D 501 source : AD7 16) chain D residue 217 type sequence G description binding site for residue NAD D 501 source : AD7 17) chain D residue 218 type sequence D description binding site for residue NAD D 501 source : AD7 18) chain D residue 231 type sequence F description binding site for residue NAD D 501 source : AD7 19) chain D residue 233 type sequence G description binding site for residue NAD D 501 source : AD7 20) chain D residue 234 type sequence G description binding site for residue NAD D 501 source : AD7 21) chain D residue 237 type sequence T description binding site for residue NAD D 501 source : AD7 22) chain D residue 240 type sequence H description binding site for residue NAD D 501 source : AD7 23) chain D residue 241 type sequence I description binding site for residue NAD D 501 source : AD7 24) chain D residue 255 type sequence E description binding site for residue NAD D 501 source : AD7 25) chain D residue 256 type sequence L description binding site for residue NAD D 501 source : AD7 26) chain D residue 257 type sequence G description binding site for residue NAD D 501 source : AD7 27) chain D residue 289 type sequence X description binding site for residue NAD D 501 source : AD7 28) chain D residue 336 type sequence H description binding site for residue NAD D 501 source : AD7 29) chain D residue 339 type sequence K description binding site for residue NAD D 501 source : AD7 30) chain D residue 390 type sequence E description binding site for residue NAD D 501 source : AD7 31) chain D residue 392 type sequence F description binding site for residue NAD D 501 source : AD7 32) chain D residue 460 type sequence K description binding site for residue NA D 502 source : AD8 33) chain D residue 463 type sequence G description binding site for residue NA D 502 source : AD8 34) chain D residue 158 type sequence Y description binding site for residue PGE D 503 source : AD9 35) chain D residue 448 type sequence H description binding site for residue PGE D 503 source : AD9

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