eF-site ID 6chh-D
PDB Code 6chh
Chain D

click to enlarge
Title Structure of human NNMT in complex with bisubstrate inhibitor MS2756
Classification TRANSFERASE/TRANSFERASE INHIBITOR
Compound Nicotinamide N-methyltransferase
Source (NNMT_HUMAN)
Sequence D:  NPRDYLEKYYKRHSAESQILKHLLKNLFKIFCLDGVKGDL
LIDIGSGPTIYQLLSACESFKEIVVTDYSDQNLQELEKWL
KAAPAAFDWSPVVTYVCDLEGNRVKGPEKEEKLRQAVKQV
LKCDVTQSQPLGAVPLPPADCVLSTLCLDAACPDLPTYCR
ALRNLGSLLKPGGFLVIMDALKSSYYMIGEQKFSSLPLGR
EAVEAAVKEAGYTIEWFEVISQSYSSTMANNEGLFSLVAR
KLS
Description


Functional site

1) chain D
residue 20
type
sequence Y
description binding site for residue F0P D 301
source : AC6

2) chain D
residue 24
type
sequence Y
description binding site for residue F0P D 301
source : AC6

3) chain D
residue 25
type
sequence Y
description binding site for residue F0P D 301
source : AC6

4) chain D
residue 63
type
sequence G
description binding site for residue F0P D 301
source : AC6

5) chain D
residue 64
type
sequence S
description binding site for residue F0P D 301
source : AC6

6) chain D
residue 65
type
sequence G
description binding site for residue F0P D 301
source : AC6

7) chain D
residue 67
type
sequence T
description binding site for residue F0P D 301
source : AC6

8) chain D
residue 69
type
sequence Y
description binding site for residue F0P D 301
source : AC6

9) chain D
residue 70
type
sequence Q
description binding site for residue F0P D 301
source : AC6

10) chain D
residue 85
type
sequence D
description binding site for residue F0P D 301
source : AC6

11) chain D
residue 86
type
sequence Y
description binding site for residue F0P D 301
source : AC6

12) chain D
residue 90
type
sequence N
description binding site for residue F0P D 301
source : AC6

13) chain D
residue 141
type
sequence C
description binding site for residue F0P D 301
source : AC6

14) chain D
residue 142
type
sequence D
description binding site for residue F0P D 301
source : AC6

15) chain D
residue 143
type
sequence V
description binding site for residue F0P D 301
source : AC6

16) chain D
residue 163
type
sequence T
description binding site for residue F0P D 301
source : AC6

17) chain D
residue 164
type
sequence L
description binding site for residue F0P D 301
source : AC6

18) chain D
residue 167
type
sequence D
description binding site for residue F0P D 301
source : AC6

19) chain D
residue 169
type
sequence A
description binding site for residue F0P D 301
source : AC6

20) chain D
residue 201
type
sequence S
description binding site for residue F0P D 301
source : AC6

21) chain D
residue 204
type
sequence Y
description binding site for residue F0P D 301
source : AC6

22) chain D
residue 213
type
sequence S
description binding site for residue F0P D 301
source : AC6

23) chain D
residue 242
type
sequence Y
description binding site for residue F0P D 301
source : AC6

24) chain D
residue 20
type BINDING
sequence Y
description BINDING => ECO:0000269|PubMed:21823666, ECO:0000269|Ref.12
source Swiss-Prot : SWS_FT_FI1

25) chain D
residue 25
type BINDING
sequence Y
description BINDING => ECO:0000269|PubMed:21823666, ECO:0000269|Ref.12
source Swiss-Prot : SWS_FT_FI1

26) chain D
residue 63
type BINDING
sequence G
description BINDING => ECO:0000269|PubMed:21823666, ECO:0000269|Ref.12
source Swiss-Prot : SWS_FT_FI1

27) chain D
residue 69
type BINDING
sequence Y
description BINDING => ECO:0000269|PubMed:21823666, ECO:0000269|Ref.12
source Swiss-Prot : SWS_FT_FI1

28) chain D
residue 85
type BINDING
sequence D
description BINDING => ECO:0000269|PubMed:21823666, ECO:0000269|Ref.12
source Swiss-Prot : SWS_FT_FI1

29) chain D
residue 90
type BINDING
sequence N
description BINDING => ECO:0000269|PubMed:21823666, ECO:0000269|Ref.12
source Swiss-Prot : SWS_FT_FI1

30) chain D
residue 142
type BINDING
sequence D
description BINDING => ECO:0000269|PubMed:21823666, ECO:0000269|Ref.12
source Swiss-Prot : SWS_FT_FI1

31) chain D
residue 163
type BINDING
sequence T
description BINDING => ECO:0000269|PubMed:21823666, ECO:0000269|Ref.12
source Swiss-Prot : SWS_FT_FI1

32) chain D
residue 197
type BINDING
sequence D
description BINDING => ECO:0000269|PubMed:21823666
source Swiss-Prot : SWS_FT_FI2

33) chain D
residue 213
type BINDING
sequence S
description BINDING => ECO:0000269|PubMed:21823666
source Swiss-Prot : SWS_FT_FI2

34) chain D
residue 18
type MOD_RES
sequence R
description Citrulline; alternate => ECO:0000269|PubMed:30044909
source Swiss-Prot : SWS_FT_FI3

35) chain D
residue 132
type MOD_RES
sequence R
description Citrulline; alternate => ECO:0000269|PubMed:30044909
source Swiss-Prot : SWS_FT_FI3

36) chain D
residue 181
type MOD_RES
sequence R
description Citrulline; alternate => ECO:0000269|PubMed:30044909
source Swiss-Prot : SWS_FT_FI3

37) chain D
residue 39
type MOD_RES
sequence K
description N6-acetyllysine => ECO:0007744|PubMed:19608861
source Swiss-Prot : SWS_FT_FI4


Display surface

Download
Links