eF-site ID 3k6l-ABC
PDB Code 3k6l
Chain A, B, C

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Title The structure of E.coli peptide deformylase (PDF) in complex with peptidomimetic ligand BB2827
Classification HYDROLASE
Compound Peptide deformylase
Source Escherichia coli (strain K12) (DEF_ECOLI)
Sequence A:  SVLQVLHIPDERLRKVAKPVEEVNAEIQRIVDDMFETMYA
EEGIGLAATQVDIHQRIIVIDVSENRDERLVLINPELLEK
SGETGIEEGCLSIPEQRALVPRAEKVKIRALDRDGKPFEL
EADGLLAICIQHEMDHLVGKLFMDYLSPLKQQRIRQKVEK
LDRL
B:  SVLQVLHIPDERLRKVAKPVEEVNAEIQRIVDDMFETMYA
EEGIGLAATQVDIHQRIIVIDVSENRDERLVLINPELLEK
SGETGIEEGCLSIPEQRALVPRAEKVKIRALDRDGKPFEL
EADGLLAICIQHEMDHLVGKLFMDYLSPLKQQRIRQKVEK
LDRL
C:  VLQVLHIPDERLRKVAKPVEEVNAEIQRIVDDMFETMYAE
EGIGLAATQVDIHQRIIVIDDERLVLINPELLEKSGETGI
EEGCLSIPEQRALVPRAEKVKIRALDRDGKPFELEADGLL
AICIQHEMDHLVGKLFMDYLSPLKQQRIRQKVE
Description


Functional site

1) chain A
residue 50
type
sequence Q
description BINDING SITE FOR RESIDUE NI A 169
source : AC1

2) chain A
residue 90
type
sequence C
description BINDING SITE FOR RESIDUE NI A 169
source : AC1

3) chain A
residue 132
type
sequence H
description BINDING SITE FOR RESIDUE NI A 169
source : AC1

4) chain A
residue 136
type
sequence H
description BINDING SITE FOR RESIDUE NI A 169
source : AC1

5) chain A
residue 42
type
sequence E
description BINDING SITE FOR RESIDUE 2BB A 170
source : AC2

6) chain A
residue 43
type
sequence G
description BINDING SITE FOR RESIDUE 2BB A 170
source : AC2

7) chain A
residue 44
type
sequence I
description BINDING SITE FOR RESIDUE 2BB A 170
source : AC2

8) chain A
residue 45
type
sequence G
description BINDING SITE FOR RESIDUE 2BB A 170
source : AC2

9) chain A
residue 50
type
sequence Q
description BINDING SITE FOR RESIDUE 2BB A 170
source : AC2

10) chain A
residue 86
type
sequence I
description BINDING SITE FOR RESIDUE 2BB A 170
source : AC2

11) chain A
residue 89
type
sequence G
description BINDING SITE FOR RESIDUE 2BB A 170
source : AC2

12) chain A
residue 90
type
sequence C
description BINDING SITE FOR RESIDUE 2BB A 170
source : AC2

13) chain A
residue 91
type
sequence L
description BINDING SITE FOR RESIDUE 2BB A 170
source : AC2

14) chain A
residue 97
type
sequence R
description BINDING SITE FOR RESIDUE 2BB A 170
source : AC2

15) chain A
residue 129
type
sequence C
description BINDING SITE FOR RESIDUE 2BB A 170
source : AC2

16) chain A
residue 132
type
sequence H
description BINDING SITE FOR RESIDUE 2BB A 170
source : AC2

17) chain A
residue 133
type
sequence E
description BINDING SITE FOR RESIDUE 2BB A 170
source : AC2

18) chain A
residue 136
type
sequence H
description BINDING SITE FOR RESIDUE 2BB A 170
source : AC2

19) chain B
residue 50
type
sequence Q
description BINDING SITE FOR RESIDUE NI B 169
source : AC3

20) chain B
residue 90
type
sequence C
description BINDING SITE FOR RESIDUE NI B 169
source : AC3

21) chain B
residue 132
type
sequence H
description BINDING SITE FOR RESIDUE NI B 169
source : AC3

22) chain B
residue 136
type
sequence H
description BINDING SITE FOR RESIDUE NI B 169
source : AC3

23) chain B
residue 42
type
sequence E
description BINDING SITE FOR RESIDUE 2BB B 170
source : AC4

24) chain B
residue 43
type
sequence G
description BINDING SITE FOR RESIDUE 2BB B 170
source : AC4

25) chain B
residue 44
type
sequence I
description BINDING SITE FOR RESIDUE 2BB B 170
source : AC4

26) chain B
residue 45
type
sequence G
description BINDING SITE FOR RESIDUE 2BB B 170
source : AC4

27) chain B
residue 50
type
sequence Q
description BINDING SITE FOR RESIDUE 2BB B 170
source : AC4

28) chain B
residue 86
type
sequence I
description BINDING SITE FOR RESIDUE 2BB B 170
source : AC4

29) chain B
residue 88
type
sequence E
description BINDING SITE FOR RESIDUE 2BB B 170
source : AC4

30) chain B
residue 89
type
sequence G
description BINDING SITE FOR RESIDUE 2BB B 170
source : AC4

31) chain B
residue 90
type
sequence C
description BINDING SITE FOR RESIDUE 2BB B 170
source : AC4

32) chain B
residue 91
type
sequence L
description BINDING SITE FOR RESIDUE 2BB B 170
source : AC4

33) chain B
residue 129
type
sequence C
description BINDING SITE FOR RESIDUE 2BB B 170
source : AC4

34) chain B
residue 132
type
sequence H
description BINDING SITE FOR RESIDUE 2BB B 170
source : AC4

35) chain B
residue 133
type
sequence E
description BINDING SITE FOR RESIDUE 2BB B 170
source : AC4

36) chain B
residue 136
type
sequence H
description BINDING SITE FOR RESIDUE 2BB B 170
source : AC4

37) chain C
residue 50
type
sequence Q
description BINDING SITE FOR RESIDUE NI C 169
source : AC5

38) chain C
residue 90
type
sequence C
description BINDING SITE FOR RESIDUE NI C 169
source : AC5

39) chain C
residue 132
type
sequence H
description BINDING SITE FOR RESIDUE NI C 169
source : AC5

40) chain C
residue 136
type
sequence H
description BINDING SITE FOR RESIDUE NI C 169
source : AC5

41) chain A
residue 45
type catalytic
sequence G
description 98
source MCSA : MCSA1

42) chain A
residue 50
type catalytic
sequence Q
description 98
source MCSA : MCSA1

43) chain A
residue 90
type catalytic
sequence C
description 98
source MCSA : MCSA1

44) chain A
residue 91
type catalytic
sequence L
description 98
source MCSA : MCSA1

45) chain A
residue 132
type catalytic
sequence H
description 98
source MCSA : MCSA1

46) chain A
residue 133
type catalytic
sequence E
description 98
source MCSA : MCSA1

47) chain A
residue 136
type catalytic
sequence H
description 98
source MCSA : MCSA1

48) chain B
residue 45
type catalytic
sequence G
description 98
source MCSA : MCSA2

49) chain B
residue 50
type catalytic
sequence Q
description 98
source MCSA : MCSA2

50) chain B
residue 90
type catalytic
sequence C
description 98
source MCSA : MCSA2

51) chain B
residue 91
type catalytic
sequence L
description 98
source MCSA : MCSA2

52) chain B
residue 132
type catalytic
sequence H
description 98
source MCSA : MCSA2

53) chain B
residue 133
type catalytic
sequence E
description 98
source MCSA : MCSA2

54) chain B
residue 136
type catalytic
sequence H
description 98
source MCSA : MCSA2

55) chain C
residue 45
type catalytic
sequence G
description 98
source MCSA : MCSA3

56) chain C
residue 50
type catalytic
sequence Q
description 98
source MCSA : MCSA3

57) chain C
residue 90
type catalytic
sequence C
description 98
source MCSA : MCSA3

58) chain C
residue 91
type catalytic
sequence L
description 98
source MCSA : MCSA3

59) chain C
residue 132
type catalytic
sequence H
description 98
source MCSA : MCSA3

60) chain C
residue 133
type catalytic
sequence E
description 98
source MCSA : MCSA3

61) chain C
residue 136
type catalytic
sequence H
description 98
source MCSA : MCSA3

62) chain A
residue 133
type ACT_SITE
sequence E
description ACT_SITE => ECO:0000269|PubMed:9846875
source Swiss-Prot : SWS_FT_FI1

63) chain B
residue 133
type ACT_SITE
sequence E
description ACT_SITE => ECO:0000269|PubMed:9846875
source Swiss-Prot : SWS_FT_FI1

64) chain C
residue 133
type ACT_SITE
sequence E
description ACT_SITE => ECO:0000269|PubMed:9846875
source Swiss-Prot : SWS_FT_FI1

65) chain A
residue 90
type BINDING
sequence C
description BINDING => ECO:0000269|PubMed:9846875
source Swiss-Prot : SWS_FT_FI2

66) chain A
residue 132
type BINDING
sequence H
description BINDING => ECO:0000269|PubMed:9846875
source Swiss-Prot : SWS_FT_FI2

67) chain A
residue 136
type BINDING
sequence H
description BINDING => ECO:0000269|PubMed:9846875
source Swiss-Prot : SWS_FT_FI2

68) chain B
residue 90
type BINDING
sequence C
description BINDING => ECO:0000269|PubMed:9846875
source Swiss-Prot : SWS_FT_FI2

69) chain B
residue 132
type BINDING
sequence H
description BINDING => ECO:0000269|PubMed:9846875
source Swiss-Prot : SWS_FT_FI2

70) chain B
residue 136
type BINDING
sequence H
description BINDING => ECO:0000269|PubMed:9846875
source Swiss-Prot : SWS_FT_FI2

71) chain C
residue 90
type BINDING
sequence C
description BINDING => ECO:0000269|PubMed:9846875
source Swiss-Prot : SWS_FT_FI2

72) chain C
residue 132
type BINDING
sequence H
description BINDING => ECO:0000269|PubMed:9846875
source Swiss-Prot : SWS_FT_FI2

73) chain C
residue 136
type BINDING
sequence H
description BINDING => ECO:0000269|PubMed:9846875
source Swiss-Prot : SWS_FT_FI2


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