eF-site ID 4p38-A
PDB Code 4p38
Chain A

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Title Human 11beta-Hydroxysteroid Dehydrogenase Type 1 in complex with AZD8329
Classification OXIDOREDUCTASE/OXIDOREDUCTASE INHIBITOR
Compound Corticosteroid 11-beta-dehydrogenase isozyme 1
Source Homo sapiens (Human) (DHI1_HUMAN)
Sequence A:  EFRPEMLQGKKVIVTGASKGIGREMAYHLAKMGAHVVVTA
RSKETLQKVVSHCLELGAASAHYIAGTMEDMTFAEQFVAQ
AGKLMGGLDMLILNHITNTSLNLFHDDIHHVRKSMEVNFL
SYVVLTVAALPMLKQSNGSIVVVSSLAGKVAYPLVAAYSA
SKFALDGFFSSIRKEYSVSRVNVSITLCVLGLIDTETAMK
AVSGIVHMQAAPKEECALEIIKGGALRQEEVYYDSSRWTT
LLIRNPSRKILEELYSTSYNWDRFI
Description


Functional site

1) chain A
residue 41
type
sequence G
description binding site for residue NDP A 301
source : AC1

2) chain A
residue 42
type
sequence A
description binding site for residue NDP A 301
source : AC1

3) chain A
residue 43
type
sequence S
description binding site for residue NDP A 301
source : AC1

4) chain A
residue 44
type
sequence K
description binding site for residue NDP A 301
source : AC1

5) chain A
residue 45
type
sequence G
description binding site for residue NDP A 301
source : AC1

6) chain A
residue 46
type
sequence I
description binding site for residue NDP A 301
source : AC1

7) chain A
residue 65
type
sequence A
description binding site for residue NDP A 301
source : AC1

8) chain A
residue 66
type
sequence R
description binding site for residue NDP A 301
source : AC1

9) chain A
residue 67
type
sequence S
description binding site for residue NDP A 301
source : AC1

10) chain A
residue 92
type
sequence T
description binding site for residue NDP A 301
source : AC1

11) chain A
residue 93
type
sequence M
description binding site for residue NDP A 301
source : AC1

12) chain A
residue 119
type
sequence N
description binding site for residue NDP A 301
source : AC1

13) chain A
residue 121
type
sequence I
description binding site for residue NDP A 301
source : AC1

14) chain A
residue 168
type
sequence V
description binding site for residue NDP A 301
source : AC1

15) chain A
residue 169
type
sequence S
description binding site for residue NDP A 301
source : AC1

16) chain A
residue 170
type
sequence S
description binding site for residue NDP A 301
source : AC1

17) chain A
residue 183
type
sequence Y
description binding site for residue NDP A 301
source : AC1

18) chain A
residue 187
type
sequence K
description binding site for residue NDP A 301
source : AC1

19) chain A
residue 215
type
sequence L
description binding site for residue NDP A 301
source : AC1

20) chain A
residue 216
type
sequence G
description binding site for residue NDP A 301
source : AC1

21) chain A
residue 217
type
sequence L
description binding site for residue NDP A 301
source : AC1

22) chain A
residue 218
type
sequence I
description binding site for residue NDP A 301
source : AC1

23) chain A
residue 220
type
sequence T
description binding site for residue NDP A 301
source : AC1

24) chain A
residue 222
type
sequence T
description binding site for residue NDP A 301
source : AC1

25) chain A
residue 223
type
sequence A
description binding site for residue NDP A 301
source : AC1

26) chain A
residue 126
type
sequence L
description binding site for residue 21T A 302
source : AC2

27) chain A
residue 170
type
sequence S
description binding site for residue 21T A 302
source : AC2

28) chain A
residue 171
type
sequence L
description binding site for residue 21T A 302
source : AC2

29) chain A
residue 183
type
sequence Y
description binding site for residue 21T A 302
source : AC2

30) chain A
residue 215
type
sequence L
description binding site for residue 21T A 302
source : AC2

31) chain A
residue 216
type
sequence G
description binding site for residue 21T A 302
source : AC2

32) chain A
residue 217
type
sequence L
description binding site for residue 21T A 302
source : AC2

33) chain A
residue 223
type
sequence A
description binding site for residue 21T A 302
source : AC2

34) chain A
residue 45
type
sequence G
description binding site for residue CL A 303
source : AC3

35) chain A
residue 48
type
sequence R
description binding site for residue CL A 303
source : AC3

36) chain A
residue 221
type
sequence E
description binding site for residue CL A 303
source : AC3

37) chain A
residue 238
type
sequence K
description binding site for residue CL A 303
source : AC3

38) chain A
residue 280
type
sequence Y
description binding site for residue 21T B 302
source : AC5

39) chain A
residue 284
type
sequence Y
description binding site for residue 21T B 302
source : AC5

40) chain A
residue 41
type BINDING
sequence G
description BINDING => ECO:0000269|PubMed:15513927, ECO:0000269|PubMed:17919905, ECO:0000269|PubMed:18069989, ECO:0000269|PubMed:18485702, ECO:0000269|PubMed:18553955, ECO:0000269|PubMed:19217779
source Swiss-Prot : SWS_FT_FI2

41) chain A
residue 92
type BINDING
sequence T
description BINDING => ECO:0000269|PubMed:15513927, ECO:0000269|PubMed:17919905, ECO:0000269|PubMed:18069989, ECO:0000269|PubMed:18485702, ECO:0000269|PubMed:18553955, ECO:0000269|PubMed:19217779
source Swiss-Prot : SWS_FT_FI2

42) chain A
residue 119
type BINDING
sequence N
description BINDING => ECO:0000269|PubMed:15513927, ECO:0000269|PubMed:17919905, ECO:0000269|PubMed:18069989, ECO:0000269|PubMed:18485702, ECO:0000269|PubMed:18553955, ECO:0000269|PubMed:19217779
source Swiss-Prot : SWS_FT_FI2

43) chain A
residue 183
type BINDING
sequence Y
description BINDING => ECO:0000269|PubMed:15513927, ECO:0000269|PubMed:17919905, ECO:0000269|PubMed:18069989, ECO:0000269|PubMed:18485702, ECO:0000269|PubMed:18553955, ECO:0000269|PubMed:19217779
source Swiss-Prot : SWS_FT_FI2

44) chain A
residue 218
type BINDING
sequence I
description BINDING => ECO:0000269|PubMed:15513927, ECO:0000269|PubMed:17919905, ECO:0000269|PubMed:18069989, ECO:0000269|PubMed:18485702, ECO:0000269|PubMed:18553955, ECO:0000269|PubMed:19217779
source Swiss-Prot : SWS_FT_FI2

45) chain A
residue 183
type ACT_SITE
sequence Y
description Proton acceptor
source Swiss-Prot : SWS_FT_FI1

46) chain A
residue 207
type CARBOHYD
sequence N
description N-linked (GlcNAc...) asparagine => ECO:0000255
source Swiss-Prot : SWS_FT_FI5

47) chain A
residue 170-198
type prosite
sequence SLAGKVAYPLVAAYSASKFALDGFFSSIR
description ADH_SHORT Short-chain dehydrogenases/reductases family signature. SlagkvayplVaaYSASKFALdGFFsSIR
source prosite : PS00061

48) chain A
residue 170
type BINDING
sequence S
description BINDING => ECO:0000269|PubMed:15513927, ECO:0007744|PDB:1XU7, ECO:0007744|PDB:1XU9
source Swiss-Prot : SWS_FT_FI3

49) chain A
residue 123
type CARBOHYD
sequence N
description N-linked (GlcNAc...) asparagine => ECO:0000269|PubMed:19159218
source Swiss-Prot : SWS_FT_FI4

50) chain A
residue 162
type CARBOHYD
sequence N
description N-linked (GlcNAc...) asparagine => ECO:0000269|PubMed:19159218
source Swiss-Prot : SWS_FT_FI4


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