eF-site ID 6vo2-AB
PDB Code 6vo2
Chain A, B

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Title Crystal structure of Staphylococcus aureus ketol-acid reductoisomerase in complex with Mg, NADPH and inhibitor.
Classification METAL BINDING PROTEIN
Compound Ketol-acid reductoisomerase (NADP(+))
Source (A0A145BYP4_STAAU)
Sequence A:  TTVYYDQDVKTDALQGKKIAVVGYGSQGHAHAQNLKDNGY
DVVIGIRPGRSFDKAKEDGFDVFPVAEAVKQADVIMVLLP
DEIQGDVYKNEIEPNLEKHNALAFAHGFNIHFGVIQPPAD
VDVFLVAPKGPGHLVRRTFVEGSAVPSLFGIQQDASGQAR
NIALSYAKGIGATRAGVIETTFKEETETDLFGEQAVLCGG
VSKLIQSGFETLVEAGYQPELAYFEVLHEMKLIVDLMYEG
GMENVRYSISNTAEFGDYVSGPRVITPDVKENMKAVLTDI
QNGNFSNRFIEDNKNGFKEFYKLREEQHGHQIEKVGRELR
EMMPFI
B:  TTVYYDQDVKTDALQGKKIAVVGYGSQGHAHAQNLKDNGY
DVVIGIRPGRSFDKAKEDGFDVFPVAEAVKQADVIMVLLP
DEIQGDVYKNEIEPNLEKHNALAFAHGFNIHFGVIQPPAD
VDVFLVAPKGPGHLVRRTFVEGSAVPSLFGIQQDASGQAR
NIALSYAKGIGATRAGVIETTFKEETETDLFGEQAVLCGG
VSKLIQSGFETLVEAGYQPELAYFEVLHEMKLIVDLMYEG
GMENVRYSISNTAEFGDYVSGPRVITPDVKENMKAVLTDI
QNGNFSNRFIEDNKNGFKEFYKLREEQHGHQIEKVGRELR
EMMPFI
Description


Functional site

1) chain A
residue 190
type
sequence D
description binding site for residue MG A 401
source : AC1

2) chain A
residue 194
type
sequence E
description binding site for residue MG A 401
source : AC1

3) chain A
residue 190
type
sequence D
description binding site for residue MG A 402
source : AC2

4) chain A
residue 230
type
sequence E
description binding site for residue R67 A 403
source : AC3

5) chain A
residue 234
type
sequence I
description binding site for residue R67 A 403
source : AC3

6) chain A
residue 250
type
sequence I
description binding site for residue R67 A 403
source : AC3

7) chain A
residue 251
type
sequence S
description binding site for residue R67 A 403
source : AC3

8) chain A
residue 254
type
sequence A
description binding site for residue R67 A 403
source : AC3

9) chain B
residue 131
type
sequence G
description binding site for residue R67 A 403
source : AC3

10) chain B
residue 132
type
sequence P
description binding site for residue R67 A 403
source : AC3

11) chain B
residue 190
type
sequence D
description binding site for residue R67 A 403
source : AC3

12) chain B
residue 194
type
sequence E
description binding site for residue R67 A 403
source : AC3

13) chain A
residue 25
type
sequence Y
description binding site for residue NDP A 404
source : AC4

14) chain A
residue 26
type
sequence G
description binding site for residue NDP A 404
source : AC4

15) chain A
residue 27
type
sequence S
description binding site for residue NDP A 404
source : AC4

16) chain A
residue 28
type
sequence Q
description binding site for residue NDP A 404
source : AC4

17) chain A
residue 47
type
sequence I
description binding site for residue NDP A 404
source : AC4

18) chain A
residue 48
type
sequence R
description binding site for residue NDP A 404
source : AC4

19) chain A
residue 52
type
sequence S
description binding site for residue NDP A 404
source : AC4

20) chain A
residue 79
type
sequence L
description binding site for residue NDP A 404
source : AC4

21) chain A
residue 80
type
sequence L
description binding site for residue NDP A 404
source : AC4

22) chain A
residue 81
type
sequence P
description binding site for residue NDP A 404
source : AC4

23) chain A
residue 82
type
sequence D
description binding site for residue NDP A 404
source : AC4

24) chain A
residue 85
type
sequence Q
description binding site for residue NDP A 404
source : AC4

25) chain A
residue 88
type
sequence V
description binding site for residue NDP A 404
source : AC4

26) chain A
residue 106
type
sequence A
description binding site for residue NDP A 404
source : AC4

27) chain A
residue 107
type
sequence H
description binding site for residue NDP A 404
source : AC4

28) chain A
residue 131
type
sequence G
description binding site for residue NDP A 404
source : AC4

29) chain A
residue 132
type
sequence P
description binding site for residue NDP A 404
source : AC4

30) chain A
residue 133
type
sequence G
description binding site for residue NDP A 404
source : AC4

31) chain B
residue 249
type
sequence S
description binding site for residue NDP A 404
source : AC4

32) chain B
residue 250
type
sequence I
description binding site for residue NDP A 404
source : AC4

33) chain B
residue 251
type
sequence S
description binding site for residue NDP A 404
source : AC4

34) chain B
residue 190
type
sequence D
description binding site for residue MG B 401
source : AC5

35) chain B
residue 190
type
sequence D
description binding site for residue MG B 402
source : AC6

36) chain B
residue 194
type
sequence E
description binding site for residue MG B 402
source : AC6

37) chain A
residue 131
type
sequence G
description binding site for residue R67 B 403
source : AC7

38) chain A
residue 132
type
sequence P
description binding site for residue R67 B 403
source : AC7

39) chain A
residue 190
type
sequence D
description binding site for residue R67 B 403
source : AC7

40) chain A
residue 194
type
sequence E
description binding site for residue R67 B 403
source : AC7

41) chain B
residue 230
type
sequence E
description binding site for residue R67 B 403
source : AC7

42) chain B
residue 250
type
sequence I
description binding site for residue R67 B 403
source : AC7

43) chain B
residue 251
type
sequence S
description binding site for residue R67 B 403
source : AC7

44) chain B
residue 254
type
sequence A
description binding site for residue R67 B 403
source : AC7

45) chain A
residue 249
type
sequence S
description binding site for residue NDP B 404
source : AC8

46) chain A
residue 250
type
sequence I
description binding site for residue NDP B 404
source : AC8

47) chain A
residue 251
type
sequence S
description binding site for residue NDP B 404
source : AC8

48) chain B
residue 25
type
sequence Y
description binding site for residue NDP B 404
source : AC8

49) chain B
residue 26
type
sequence G
description binding site for residue NDP B 404
source : AC8

50) chain B
residue 27
type
sequence S
description binding site for residue NDP B 404
source : AC8

51) chain B
residue 28
type
sequence Q
description binding site for residue NDP B 404
source : AC8

52) chain B
residue 47
type
sequence I
description binding site for residue NDP B 404
source : AC8

53) chain B
residue 48
type
sequence R
description binding site for residue NDP B 404
source : AC8

54) chain B
residue 52
type
sequence S
description binding site for residue NDP B 404
source : AC8

55) chain B
residue 79
type
sequence L
description binding site for residue NDP B 404
source : AC8

56) chain B
residue 80
type
sequence L
description binding site for residue NDP B 404
source : AC8

57) chain B
residue 81
type
sequence P
description binding site for residue NDP B 404
source : AC8

58) chain B
residue 82
type
sequence D
description binding site for residue NDP B 404
source : AC8

59) chain B
residue 85
type
sequence Q
description binding site for residue NDP B 404
source : AC8

60) chain B
residue 88
type
sequence V
description binding site for residue NDP B 404
source : AC8

61) chain B
residue 106
type
sequence A
description binding site for residue NDP B 404
source : AC8

62) chain B
residue 107
type
sequence H
description binding site for residue NDP B 404
source : AC8

63) chain B
residue 132
type
sequence P
description binding site for residue NDP B 404
source : AC8

64) chain B
residue 133
type
sequence G
description binding site for residue NDP B 404
source : AC8

65) chain A
residue 107
type ACT_SITE
sequence H
description ACT_SITE => ECO:0000255|HAMAP-Rule:MF_00435
source Swiss-Prot : SWS_FT_FI1

66) chain B
residue 107
type ACT_SITE
sequence H
description ACT_SITE => ECO:0000255|HAMAP-Rule:MF_00435
source Swiss-Prot : SWS_FT_FI1

67) chain A
residue 251
type BINDING
sequence S
description BINDING => ECO:0000255|HAMAP-Rule:MF_00435
source Swiss-Prot : SWS_FT_FI2

68) chain B
residue 25
type BINDING
sequence Y
description BINDING => ECO:0000255|HAMAP-Rule:MF_00435
source Swiss-Prot : SWS_FT_FI2

69) chain B
residue 48
type BINDING
sequence R
description BINDING => ECO:0000255|HAMAP-Rule:MF_00435
source Swiss-Prot : SWS_FT_FI2

70) chain B
residue 52
type BINDING
sequence S
description BINDING => ECO:0000255|HAMAP-Rule:MF_00435
source Swiss-Prot : SWS_FT_FI2

71) chain B
residue 82
type BINDING
sequence D
description BINDING => ECO:0000255|HAMAP-Rule:MF_00435
source Swiss-Prot : SWS_FT_FI2

72) chain B
residue 133
type BINDING
sequence G
description BINDING => ECO:0000255|HAMAP-Rule:MF_00435
source Swiss-Prot : SWS_FT_FI2

73) chain B
residue 190
type BINDING
sequence D
description BINDING => ECO:0000255|HAMAP-Rule:MF_00435
source Swiss-Prot : SWS_FT_FI2

74) chain B
residue 194
type BINDING
sequence E
description BINDING => ECO:0000255|HAMAP-Rule:MF_00435
source Swiss-Prot : SWS_FT_FI2

75) chain B
residue 226
type BINDING
sequence E
description BINDING => ECO:0000255|HAMAP-Rule:MF_00435
source Swiss-Prot : SWS_FT_FI2

76) chain B
residue 230
type BINDING
sequence E
description BINDING => ECO:0000255|HAMAP-Rule:MF_00435
source Swiss-Prot : SWS_FT_FI2

77) chain B
residue 251
type BINDING
sequence S
description BINDING => ECO:0000255|HAMAP-Rule:MF_00435
source Swiss-Prot : SWS_FT_FI2

78) chain A
residue 52
type BINDING
sequence S
description BINDING => ECO:0000255|HAMAP-Rule:MF_00435
source Swiss-Prot : SWS_FT_FI2

79) chain A
residue 82
type BINDING
sequence D
description BINDING => ECO:0000255|HAMAP-Rule:MF_00435
source Swiss-Prot : SWS_FT_FI2

80) chain A
residue 133
type BINDING
sequence G
description BINDING => ECO:0000255|HAMAP-Rule:MF_00435
source Swiss-Prot : SWS_FT_FI2

81) chain A
residue 190
type BINDING
sequence D
description BINDING => ECO:0000255|HAMAP-Rule:MF_00435
source Swiss-Prot : SWS_FT_FI2

82) chain A
residue 194
type BINDING
sequence E
description BINDING => ECO:0000255|HAMAP-Rule:MF_00435
source Swiss-Prot : SWS_FT_FI2

83) chain A
residue 226
type BINDING
sequence E
description BINDING => ECO:0000255|HAMAP-Rule:MF_00435
source Swiss-Prot : SWS_FT_FI2

84) chain A
residue 230
type BINDING
sequence E
description BINDING => ECO:0000255|HAMAP-Rule:MF_00435
source Swiss-Prot : SWS_FT_FI2

85) chain A
residue 25
type BINDING
sequence Y
description BINDING => ECO:0000255|HAMAP-Rule:MF_00435
source Swiss-Prot : SWS_FT_FI2

86) chain A
residue 48
type BINDING
sequence R
description BINDING => ECO:0000255|HAMAP-Rule:MF_00435
source Swiss-Prot : SWS_FT_FI2


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