eF-site ID 4zwl-G
PDB Code 4zwl
Chain G

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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 G:  MELLKHLSQRQYIDGEWVESANKNTRDIINPYNQEVIFTV
SEGTKEDAERAILAARRAFESGEWSQETAETRGKKVRAIA
DKIKEHREALARLETLDTGKTLEESYADMDDIHNVFMYFA
GLADKDGGEMIDSPIPDTESKIVKEPVGVVTQITPWNYPL
LQASWKIAPALATGCSLVMKPSEITPLTTIRVFELMEEVG
FPKGTINLILGAGSEVGDVMSGHKEVDLVSFTGGIETGKH
IMKNAANNVTNIALELGGKNPNIIFDDADFELAVDQALNG
GYFHAGQVCSAGSRILVQNSIKDKFEQALIDRVKKIKLGN
GFDADTEMGPVISTEHRNKIESYMDVAKAEGATIAVGGKR
PDRDDLKDGLFFEPTVITNCDTSMRIVQEEVFGPVVTVEG
FETEQEAIQLANDSIYGLAGAVFSKDIGKAQRVANKLKLG
TVWINDFFPLFAQAPWGGYKQSGIGRELGKEGLEEYLVSK
HILTNTNPQLVNWFSK
Description


Functional site

1) chain G
residue 304
type
sequence K
description binding site for residue SO4 B 502
source : AC5

2) chain G
residue 317
type
sequence K
description binding site for residue SO4 C 502
source : AC8

3) chain G
residue 243
type
sequence K
description binding site for residue SO4 F 502
source : AD7

4) chain G
residue 153
type
sequence I
description binding site for residue NAD G 501
source : AE1

5) chain G
residue 154
type
sequence T
description binding site for residue NAD G 501
source : AE1

6) chain G
residue 155
type
sequence P
description binding site for residue NAD G 501
source : AE1

7) chain G
residue 156
type
sequence W
description binding site for residue NAD G 501
source : AE1

8) chain G
residue 162
type
sequence Q
description binding site for residue NAD G 501
source : AE1

9) chain G
residue 180
type
sequence K
description binding site for residue NAD G 501
source : AE1

10) chain G
residue 182
type
sequence S
description binding site for residue NAD G 501
source : AE1

11) chain G
residue 183
type
sequence E
description binding site for residue NAD G 501
source : AE1

12) chain G
residue 213
type
sequence G
description binding site for residue NAD G 501
source : AE1

13) chain G
residue 217
type
sequence G
description binding site for residue NAD G 501
source : AE1

14) chain G
residue 218
type
sequence D
description binding site for residue NAD G 501
source : AE1

15) chain G
residue 231
type
sequence F
description binding site for residue NAD G 501
source : AE1

16) chain G
residue 232
type
sequence T
description binding site for residue NAD G 501
source : AE1

17) chain G
residue 233
type
sequence G
description binding site for residue NAD G 501
source : AE1

18) chain G
residue 234
type
sequence G
description binding site for residue NAD G 501
source : AE1

19) chain G
residue 237
type
sequence T
description binding site for residue NAD G 501
source : AE1

20) chain G
residue 240
type
sequence H
description binding site for residue NAD G 501
source : AE1

21) chain G
residue 255
type
sequence E
description binding site for residue NAD G 501
source : AE1

22) chain G
residue 256
type
sequence L
description binding site for residue NAD G 501
source : AE1

23) chain G
residue 257
type
sequence G
description binding site for residue NAD G 501
source : AE1

24) chain G
residue 289
type
sequence C
description binding site for residue NAD G 501
source : AE1

25) chain G
residue 390
type
sequence E
description binding site for residue NAD G 501
source : AE1

26) chain G
residue 392
type
sequence F
description binding site for residue NAD G 501
source : AE1

27) chain G
residue 418
type
sequence L
description binding site for residue NAD G 501
source : AE1

28) chain G
residue 456
type
sequence W
description binding site for residue NAD G 501
source : AE1

29) chain G
residue 334
type
sequence T
description binding site for residue SO4 G 502
source : AE2

30) chain G
residue 337
type
sequence R
description binding site for residue SO4 G 502
source : AE2

31) chain G
residue 338
type
sequence N
description binding site for residue SO4 G 502
source : AE2

32) chain G
residue 360
type
sequence R
description binding site for residue SO4 G 502
source : AE2

33) chain G
residue 314
type
sequence K
description binding site for residue SO4 G 503
source : AE3

34) chain G
residue 385
type
sequence R
description binding site for residue SO4 G 504
source : AE4


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