eF-site ID 4h2x-ABCD
PDB Code 4h2x
Chain A, B, C, D

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Title Crystal structure of engineered Bradyrhizobium japonicum glycine:[carrier protein] ligase complexed with carrier protein from Agrobacterium tumefaciens and an analogue of glycyl adenylate
Classification LIGASE
Compound Amino acid--[acyl-carrier-protein] ligase 1
Source Bradyrhizobium diazoefficiens (strain JCM 10833 / IAM 13628 / NBRC 14792 / USDA 110) (AACP_AGRT5)
Sequence A:  DPLDHLADKLFHSMGSDGVYARTALYESIVERLAALITSH
REAGTEALRFPPVMSRAQLEKSGYLKSFPNLLGCVCGLHG
TEREINAAVSRFDAGGDWTTSLSPADLVLSPAAXYPVYPI
AASRGPLPKGGLRFDVAADCFRREPSKHLDRLQSFRMREY
VCIGTPDDVSDFRERWMVRAQAIARDLGLTFRVDYASDPF
FGRAGKMLANNQRDQQLKFELLIPLRSEEQPTACMSFNYH
REHFGTTWGIQDANGEPAHTGXVAFGMDRLAVAMFHTHGT
DLSAWPAKVRDILGL
B:  ADPLDHLADKLFHSMGSDGVYARTALYESIVERLAALITS
HREAGTEALRFPPVMSRAQLEKSGYLKSFPNLLGCVCGLH
GTEREINAAVSRFDAGGDWTTSLSPADLVLSPAACYPVYP
IAASRGPLPKGGLRFDVAADCFRREPSKHLDRLQSFRMRE
YVCIGTPDDVSDFRERWMVRAQAIARDLGLTFRVDYASDP
FFGRAGKMLANNQRDQQLKFELLIPLRSEEQPTACMSFNY
HREHFGTTWGIQDANGEPAHTGCVAFGMDRLAVAMFHTHG
TDLSAWPAKVRDILGL
C:  HMNATIREILAKFGQLPTPVDTIADEADLYAAGLSSFASV
QLMLGIEEAFDIEFPDNLLNRKSFASIKAIEDTVKLI
D:  MNATIREILAKFGQLPTPVDTIADEADLYAAGLSSFASVQ
LMLGIEEAFDIEFPDNLLNRKSFASIKAIEDTVKL
Description (1)  Amino acid--[acyl-carrier-protein] ligase 1 (E.C.6.2.1.-), Aminoacyl carrier protein


Functional site

1) chain A
residue 129
type
sequence A
description BINDING SITE FOR RESIDUE G5A A 401
source : AC1

2) chain A
residue 131
type
sequence X
description BINDING SITE FOR RESIDUE G5A A 401
source : AC1

3) chain A
residue 159
type
sequence R
description BINDING SITE FOR RESIDUE G5A A 401
source : AC1

4) chain A
residue 169
type
sequence L
description BINDING SITE FOR RESIDUE G5A A 401
source : AC1

5) chain A
residue 172
type
sequence F
description BINDING SITE FOR RESIDUE G5A A 401
source : AC1

6) chain A
residue 174
type
sequence M
description BINDING SITE FOR RESIDUE G5A A 401
source : AC1

7) chain A
residue 176
type
sequence E
description BINDING SITE FOR RESIDUE G5A A 401
source : AC1

8) chain A
residue 235
type
sequence K
description BINDING SITE FOR RESIDUE G5A A 401
source : AC1

9) chain A
residue 250
type
sequence A
description BINDING SITE FOR RESIDUE G5A A 401
source : AC1

10) chain A
residue 251
type
sequence C
description BINDING SITE FOR RESIDUE G5A A 401
source : AC1

11) chain A
residue 253
type
sequence S
description BINDING SITE FOR RESIDUE G5A A 401
source : AC1

12) chain A
residue 255
type
sequence N
description BINDING SITE FOR RESIDUE G5A A 401
source : AC1

13) chain A
residue 279
type
sequence X
description BINDING SITE FOR RESIDUE G5A A 401
source : AC1

14) chain A
residue 281
type
sequence A
description BINDING SITE FOR RESIDUE G5A A 401
source : AC1

15) chain A
residue 283
type
sequence G
description BINDING SITE FOR RESIDUE G5A A 401
source : AC1

16) chain A
residue 286
type
sequence R
description BINDING SITE FOR RESIDUE G5A A 401
source : AC1

17) chain A
residue 283
type
sequence G
description BINDING SITE FOR RESIDUE CL A 402
source : AC2

18) chain A
residue 284
type
sequence M
description BINDING SITE FOR RESIDUE CL A 402
source : AC2

19) chain A
residue 285
type
sequence D
description BINDING SITE FOR RESIDUE CL A 402
source : AC2

20) chain A
residue 286
type
sequence R
description BINDING SITE FOR RESIDUE CL A 402
source : AC2

21) chain B
residue 131
type
sequence C
description BINDING SITE FOR RESIDUE ZN B 401
source : AC3

22) chain B
residue 176
type
sequence E
description BINDING SITE FOR RESIDUE ZN B 401
source : AC3

23) chain B
residue 279
type
sequence C
description BINDING SITE FOR RESIDUE ZN B 401
source : AC3

24) chain B
residue 129
type
sequence A
description BINDING SITE FOR RESIDUE G5A B 402
source : AC4

25) chain B
residue 131
type
sequence C
description BINDING SITE FOR RESIDUE G5A B 402
source : AC4

26) chain B
residue 159
type
sequence R
description BINDING SITE FOR RESIDUE G5A B 402
source : AC4

27) chain B
residue 161
type
sequence E
description BINDING SITE FOR RESIDUE G5A B 402
source : AC4

28) chain B
residue 169
type
sequence L
description BINDING SITE FOR RESIDUE G5A B 402
source : AC4

29) chain B
residue 172
type
sequence F
description BINDING SITE FOR RESIDUE G5A B 402
source : AC4

30) chain B
residue 174
type
sequence M
description BINDING SITE FOR RESIDUE G5A B 402
source : AC4

31) chain B
residue 176
type
sequence E
description BINDING SITE FOR RESIDUE G5A B 402
source : AC4

32) chain B
residue 235
type
sequence K
description BINDING SITE FOR RESIDUE G5A B 402
source : AC4

33) chain B
residue 250
type
sequence A
description BINDING SITE FOR RESIDUE G5A B 402
source : AC4

34) chain B
residue 251
type
sequence C
description BINDING SITE FOR RESIDUE G5A B 402
source : AC4

35) chain B
residue 252
type
sequence M
description BINDING SITE FOR RESIDUE G5A B 402
source : AC4

36) chain B
residue 253
type
sequence S
description BINDING SITE FOR RESIDUE G5A B 402
source : AC4

37) chain B
residue 255
type
sequence N
description BINDING SITE FOR RESIDUE G5A B 402
source : AC4

38) chain B
residue 281
type
sequence A
description BINDING SITE FOR RESIDUE G5A B 402
source : AC4

39) chain B
residue 283
type
sequence G
description BINDING SITE FOR RESIDUE G5A B 402
source : AC4

40) chain B
residue 286
type
sequence R
description BINDING SITE FOR RESIDUE G5A B 402
source : AC4

41) chain B
residue 283
type
sequence G
description BINDING SITE FOR RESIDUE CL B 403
source : AC5

42) chain B
residue 284
type
sequence M
description BINDING SITE FOR RESIDUE CL B 403
source : AC5

43) chain B
residue 285
type
sequence D
description BINDING SITE FOR RESIDUE CL B 403
source : AC5

44) chain B
residue 286
type
sequence R
description BINDING SITE FOR RESIDUE CL B 403
source : AC5

45) chain B
residue 132
type
sequence Y
description BINDING SITE FOR RESIDUE PNS C 101
source : AC6

46) chain B
residue 215
type
sequence D
description BINDING SITE FOR RESIDUE PNS C 101
source : AC6

47) chain B
residue 228
type
sequence N
description BINDING SITE FOR RESIDUE PNS C 101
source : AC6

48) chain B
residue 232
type
sequence Q
description BINDING SITE FOR RESIDUE PNS C 101
source : AC6

49) chain B
residue 234
type
sequence L
description BINDING SITE FOR RESIDUE PNS C 101
source : AC6

50) chain B
residue 257
type
sequence H
description BINDING SITE FOR RESIDUE PNS C 101
source : AC6

51) chain B
residue 260
type
sequence H
description BINDING SITE FOR RESIDUE PNS C 101
source : AC6

52) chain C
residue 35
type
sequence S
description BINDING SITE FOR RESIDUE PNS C 101
source : AC6

53) chain A
residue 131
type
sequence X
description BINDING SITE FOR RESIDUE PNS D 101
source : AC7

54) chain A
residue 132
type
sequence Y
description BINDING SITE FOR RESIDUE PNS D 101
source : AC7

55) chain A
residue 215
type
sequence D
description BINDING SITE FOR RESIDUE PNS D 101
source : AC7

56) chain A
residue 228
type
sequence N
description BINDING SITE FOR RESIDUE PNS D 101
source : AC7

57) chain A
residue 232
type
sequence Q
description BINDING SITE FOR RESIDUE PNS D 101
source : AC7

58) chain A
residue 257
type
sequence H
description BINDING SITE FOR RESIDUE PNS D 101
source : AC7

59) chain A
residue 260
type
sequence H
description BINDING SITE FOR RESIDUE PNS D 101
source : AC7

60) chain D
residue 35
type
sequence S
description BINDING SITE FOR RESIDUE PNS D 101
source : AC7

61) chain D
residue 36
type
sequence F
description BINDING SITE FOR RESIDUE PNS D 101
source : AC7

62) chain C
residue 35
type MOD_RES
sequence S
description O-(pantetheine 4'-phosphoryl)serine => ECO:0000255|PROSITE-ProRule:PRU00258
source Swiss-Prot : SWS_FT_FI1

63) chain D
residue 35
type MOD_RES
sequence S
description O-(pantetheine 4'-phosphoryl)serine => ECO:0000255|PROSITE-ProRule:PRU00258
source Swiss-Prot : SWS_FT_FI1

64) chain B
residue 161
type MOD_RES
sequence E
description O-(pantetheine 4'-phosphoryl)serine => ECO:0000255|PROSITE-ProRule:PRU00258
source Swiss-Prot : SWS_FT_FI1

65) chain B
residue 168
type MOD_RES
sequence R
description O-(pantetheine 4'-phosphoryl)serine => ECO:0000255|PROSITE-ProRule:PRU00258
source Swiss-Prot : SWS_FT_FI1

66) chain B
residue 176
type MOD_RES
sequence E
description O-(pantetheine 4'-phosphoryl)serine => ECO:0000255|PROSITE-ProRule:PRU00258
source Swiss-Prot : SWS_FT_FI1

67) chain B
residue 235
type MOD_RES
sequence K
description O-(pantetheine 4'-phosphoryl)serine => ECO:0000255|PROSITE-ProRule:PRU00258
source Swiss-Prot : SWS_FT_FI1

68) chain B
residue 250
type MOD_RES
sequence A
description O-(pantetheine 4'-phosphoryl)serine => ECO:0000255|PROSITE-ProRule:PRU00258
source Swiss-Prot : SWS_FT_FI1

69) chain B
residue 279
type MOD_RES
sequence C
description O-(pantetheine 4'-phosphoryl)serine => ECO:0000255|PROSITE-ProRule:PRU00258
source Swiss-Prot : SWS_FT_FI1

70) chain B
residue 286
type MOD_RES
sequence R
description O-(pantetheine 4'-phosphoryl)serine => ECO:0000255|PROSITE-ProRule:PRU00258
source Swiss-Prot : SWS_FT_FI1


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