eF-site ID 1dyh-AB
PDB Code 1dyh
Chain A, B

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Title ISOMORPHOUS CRYSTAL STRUCTURES OF ESCHERICHIA COLI DIHYDROFOLATE REDUCTASE COMPLEXED WITH FOLATE, 5-DEAZAFOLATE AND 5,10-DIDEAZATETRAHYDROFOLATE: MECHANISTIC IMPLICATIONS
Classification OXIDOREDUCTASE
Compound DIHYDROFOLATE REDUCTASE
Source Escherichia coli (strain K12) (DYR_ECOLI)
Sequence A:  MISLIAALAVDRVIGMENAMPWNLPADLAWFKRNTLDKPV
IMGRHTWESIGRPLPGRKNIILSSQPGTDDRVTWVKSVDE
AIAACGDVPEIMVIGGGRVYEQFLPKAQKLYLTHIDAEVE
GDTHFPDYEPDDWESVFSEFHDADAQNSHSYCFEILERR
B:  MISLIAALAVDRVIGMENAMPWNLPADLAWFKRNTLDKPV
IMGRHTWESIGRPLPGRKNIILSSQPGTDDRVTWVKSVDE
AIAACGDVPEIMVIGGGRVYEQFLPKAQKLYLTHIDAEVE
GDTHFPDYEPDDWESVFSEFHDADAQNSHSYCFEILERR
Description


Functional site

1) chain A
residue 43
type
sequence G
description BINDING SITE FOR RESIDUE CL A 401
source : AC1

2) chain A
residue 45
type
sequence H
description BINDING SITE FOR RESIDUE CL A 401
source : AC1

3) chain A
residue 46
type
sequence T
description BINDING SITE FOR RESIDUE CL A 401
source : AC1

4) chain A
residue 96
type
sequence G
description BINDING SITE FOR RESIDUE CL A 401
source : AC1

5) chain B
residue 43
type
sequence G
description BINDING SITE FOR RESIDUE CL B 405
source : AC2

6) chain B
residue 45
type
sequence H
description BINDING SITE FOR RESIDUE CL B 405
source : AC2

7) chain B
residue 46
type
sequence T
description BINDING SITE FOR RESIDUE CL B 405
source : AC2

8) chain B
residue 96
type
sequence G
description BINDING SITE FOR RESIDUE CL B 405
source : AC2

9) chain B
residue 135
type
sequence S
description BINDING SITE FOR RESIDUE CA B 420
source : AC3

10) chain A
residue 5
type
sequence I
description BINDING SITE FOR RESIDUE DZF A 161
source : AC4

11) chain A
residue 6
type
sequence A
description BINDING SITE FOR RESIDUE DZF A 161
source : AC4

12) chain A
residue 7
type
sequence A
description BINDING SITE FOR RESIDUE DZF A 161
source : AC4

13) chain A
residue 27
type
sequence D
description BINDING SITE FOR RESIDUE DZF A 161
source : AC4

14) chain A
residue 28
type
sequence L
description BINDING SITE FOR RESIDUE DZF A 161
source : AC4

15) chain A
residue 31
type
sequence F
description BINDING SITE FOR RESIDUE DZF A 161
source : AC4

16) chain A
residue 46
type
sequence T
description BINDING SITE FOR RESIDUE DZF A 161
source : AC4

17) chain A
residue 50
type
sequence I
description BINDING SITE FOR RESIDUE DZF A 161
source : AC4

18) chain A
residue 52
type
sequence R
description BINDING SITE FOR RESIDUE DZF A 161
source : AC4

19) chain A
residue 57
type
sequence R
description BINDING SITE FOR RESIDUE DZF A 161
source : AC4

20) chain A
residue 94
type
sequence I
description BINDING SITE FOR RESIDUE DZF A 161
source : AC4

21) chain A
residue 113
type
sequence T
description BINDING SITE FOR RESIDUE DZF A 161
source : AC4

22) chain B
residue 5
type
sequence I
description BINDING SITE FOR RESIDUE DZF B 161
source : AC5

23) chain B
residue 6
type
sequence A
description BINDING SITE FOR RESIDUE DZF B 161
source : AC5

24) chain B
residue 7
type
sequence A
description BINDING SITE FOR RESIDUE DZF B 161
source : AC5

25) chain B
residue 27
type
sequence D
description BINDING SITE FOR RESIDUE DZF B 161
source : AC5

26) chain B
residue 28
type
sequence L
description BINDING SITE FOR RESIDUE DZF B 161
source : AC5

27) chain B
residue 31
type
sequence F
description BINDING SITE FOR RESIDUE DZF B 161
source : AC5

28) chain B
residue 32
type
sequence K
description BINDING SITE FOR RESIDUE DZF B 161
source : AC5

29) chain B
residue 50
type
sequence I
description BINDING SITE FOR RESIDUE DZF B 161
source : AC5

30) chain B
residue 52
type
sequence R
description BINDING SITE FOR RESIDUE DZF B 161
source : AC5

31) chain B
residue 57
type
sequence R
description BINDING SITE FOR RESIDUE DZF B 161
source : AC5

32) chain B
residue 94
type
sequence I
description BINDING SITE FOR RESIDUE DZF B 161
source : AC5

33) chain B
residue 100
type
sequence Y
description BINDING SITE FOR RESIDUE DZF B 161
source : AC5

34) chain B
residue 113
type
sequence T
description BINDING SITE FOR RESIDUE DZF B 161
source : AC5

35) chain A
residue 13-35
type prosite
sequence VIGMENAMPWNLPADLAWFKRNT
description DHFR_1 Dihydrofolate reductase (DHFR) domain signature. VIGmenaMPWnlpa.DlawFkrnT
source prosite : PS00075

36) chain A
residue 5
type BINDING
sequence I
description BINDING => ECO:0000305|PubMed:9012674
source Swiss-Prot : SWS_FT_FI1

37) chain B
residue 113
type BINDING
sequence T
description BINDING => ECO:0000305|PubMed:9012674
source Swiss-Prot : SWS_FT_FI1

38) chain A
residue 27
type BINDING
sequence D
description BINDING => ECO:0000305|PubMed:9012674
source Swiss-Prot : SWS_FT_FI1

39) chain A
residue 52
type BINDING
sequence R
description BINDING => ECO:0000305|PubMed:9012674
source Swiss-Prot : SWS_FT_FI1

40) chain A
residue 57
type BINDING
sequence R
description BINDING => ECO:0000305|PubMed:9012674
source Swiss-Prot : SWS_FT_FI1

41) chain A
residue 113
type BINDING
sequence T
description BINDING => ECO:0000305|PubMed:9012674
source Swiss-Prot : SWS_FT_FI1

42) chain B
residue 5
type BINDING
sequence I
description BINDING => ECO:0000305|PubMed:9012674
source Swiss-Prot : SWS_FT_FI1

43) chain B
residue 27
type BINDING
sequence D
description BINDING => ECO:0000305|PubMed:9012674
source Swiss-Prot : SWS_FT_FI1

44) chain B
residue 52
type BINDING
sequence R
description BINDING => ECO:0000305|PubMed:9012674
source Swiss-Prot : SWS_FT_FI1

45) chain B
residue 57
type BINDING
sequence R
description BINDING => ECO:0000305|PubMed:9012674
source Swiss-Prot : SWS_FT_FI1

46) chain A
residue 7
type BINDING
sequence A
description BINDING => ECO:0000269|PubMed:19374017
source Swiss-Prot : SWS_FT_FI2

47) chain B
residue 63
type BINDING
sequence S
description BINDING => ECO:0000269|PubMed:19374017
source Swiss-Prot : SWS_FT_FI2

48) chain B
residue 76
type BINDING
sequence K
description BINDING => ECO:0000269|PubMed:19374017
source Swiss-Prot : SWS_FT_FI2

49) chain B
residue 95
type BINDING
sequence G
description BINDING => ECO:0000269|PubMed:19374017
source Swiss-Prot : SWS_FT_FI2

50) chain A
residue 13
type BINDING
sequence V
description BINDING => ECO:0000269|PubMed:19374017
source Swiss-Prot : SWS_FT_FI2

51) chain A
residue 45
type BINDING
sequence H
description BINDING => ECO:0000269|PubMed:19374017
source Swiss-Prot : SWS_FT_FI2

52) chain A
residue 63
type BINDING
sequence S
description BINDING => ECO:0000269|PubMed:19374017
source Swiss-Prot : SWS_FT_FI2

53) chain A
residue 76
type BINDING
sequence K
description BINDING => ECO:0000269|PubMed:19374017
source Swiss-Prot : SWS_FT_FI2

54) chain A
residue 95
type BINDING
sequence G
description BINDING => ECO:0000269|PubMed:19374017
source Swiss-Prot : SWS_FT_FI2

55) chain B
residue 7
type BINDING
sequence A
description BINDING => ECO:0000269|PubMed:19374017
source Swiss-Prot : SWS_FT_FI2

56) chain B
residue 13
type BINDING
sequence V
description BINDING => ECO:0000269|PubMed:19374017
source Swiss-Prot : SWS_FT_FI2

57) chain B
residue 45
type BINDING
sequence H
description BINDING => ECO:0000269|PubMed:19374017
source Swiss-Prot : SWS_FT_FI2


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