eF-site ID 4zwl-E PDB Code 4zwl Chain E click to enlarge Title 2.60 Angstrom resolution crystal structure of betaine aldehyde dehydrogenase (betB) H448F/Y450L double mutant from Staphylococcus aureus in complex with NAD+ and BME-free Cys289 Classification OXIDOREDUCTASE Compound Betaine-aldehyde dehydrogenase Source Staphylococcus aureus (strain COL) (Q5HCU0_STAAC) Sequence E:  MELLKHLSQRQYIDGEWVESANKNTRDIINPYNQEVIFTV SEGTKEDAERAILAARRAFESGEWSQETAETRGKKVRAIA DKIKEHREALARLETLDTGKTLEESYADMDDIHNVFMYFA GLADKDGGEMIDSPIPDTESKIVKEPVGVVTQITPWNYPL LQASWKIAPALATGCSLVMKPSEITPLTTIRVFELMEEVG FPKGTINLILGAGSEVGDVMSGHKEVDLVSFTGGIETGKH IMKNAANNVTNIALELGGKNPNIIFDDADFELAVDQALNG GYFHAGQVCSAGSRILVQNSIKDKFEQALIDRVKKIKLGN GFDADTEMGPVISTEHRNKIESYMDVAKAEGATIAVGGKR PDRDDLKDGLFFEPTVITNCDTSMRIVQEEVFGPVVTVEG FETEQEAIQLANDSIYGLAGAVFSKDIGKAQRVANKLKLG TVWINDFFPLFAQAPWGGYKQSGIGRELGKEGLEEYLVSK HILTNTNPQLVNWFSK Description Functional site 1) chain E residue 153 type sequence I description binding site for residue NAD E 501 source : AD3 2) chain E residue 154 type sequence T description binding site for residue NAD E 501 source : AD3 3) chain E residue 155 type sequence P description binding site for residue NAD E 501 source : AD3 4) chain E residue 156 type sequence W description binding site for residue NAD E 501 source : AD3 5) chain E residue 157 type sequence N description binding site for residue NAD E 501 source : AD3 6) chain E residue 162 type sequence Q description binding site for residue NAD E 501 source : AD3 7) chain E residue 180 type sequence K description binding site for residue NAD E 501 source : AD3 8) chain E residue 182 type sequence S description binding site for residue NAD E 501 source : AD3 9) chain E residue 183 type sequence E description binding site for residue NAD E 501 source : AD3 10) chain E residue 213 type sequence G description binding site for residue NAD E 501 source : AD3 11) chain E residue 217 type sequence G description binding site for residue NAD E 501 source : AD3 12) chain E residue 231 type sequence F description binding site for residue NAD E 501 source : AD3 13) chain E residue 232 type sequence T description binding site for residue NAD E 501 source : AD3 14) chain E residue 233 type sequence G description binding site for residue NAD E 501 source : AD3 15) chain E residue 234 type sequence G description binding site for residue NAD E 501 source : AD3 16) chain E residue 237 type sequence T description binding site for residue NAD E 501 source : AD3 17) chain E residue 240 type sequence H description binding site for residue NAD E 501 source : AD3 18) chain E residue 241 type sequence I description binding site for residue NAD E 501 source : AD3 19) chain E residue 255 type sequence E description binding site for residue NAD E 501 source : AD3 20) chain E residue 256 type sequence L description binding site for residue NAD E 501 source : AD3 21) chain E residue 257 type sequence G description binding site for residue NAD E 501 source : AD3 22) chain E residue 289 type sequence C description binding site for residue NAD E 501 source : AD3 23) chain E residue 390 type sequence E description binding site for residue NAD E 501 source : AD3 24) chain E residue 392 type sequence F description binding site for residue NAD E 501 source : AD3 25) chain E residue 418 type sequence L description binding site for residue NAD E 501 source : AD3 26) chain E residue 456 type sequence W description binding site for residue NAD E 501 source : AD3 27) chain E residue 265 type sequence F description binding site for residue SO4 E 502 source : AD4 28) chain E residue 298 type sequence Q description binding site for residue SO4 E 502 source : AD4 29) chain E residue 404 type sequence E description binding site for residue SO4 E 502 source : AD4 30) chain E residue 429 type sequence K description binding site for residue SO4 E 502 source : AD4 31) chain E residue 338 type sequence N description binding site for residue SO4 E 503 source : AD5 32) chain E residue 360 type sequence R description binding site for residue SO4 E 503 source : AD5

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