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

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Title Reactivated Nitrogenase MoFe-protein from A. vinelandii
Classification OXIDOREDUCTASE
Compound Nitrogenase molybdenum-iron protein alpha chain
Source ORGANISM_SCIENTIFIC: Azotobacter vinelandii;
Sequence A:  MSREEVESLIQEVLEVYPEKARKDRNKHLAVNDPAVTQSK
KCIISNKKSQPGLMTIRGCAYAGSKGVVWGPIKDMIHISH
GPVGCGQYSRAGRRNYYIGTTGVNAFVTMNFTSDFQEKDI
VFGGDKKLAKLIDEVETLFPLNKGISVQSECPIGLIGDDI
ESVSKVKGAELSKTIVPVRCEGFRGVSQSLGHHIANDAVR
DWVLGKRDEDTTFASTPYDVAIIGDYNIGGDAWSSRILLE
EMGLRCVAQWSGDGSISEIELTPKVKLNLVHCYRSMNYIS
RHMEEKYGIPWMEYNFFGPTKTIESLRAIAAKFDESIQKK
CEEVIAKYKPEWEAVVAKYRPRLEGKRVMLYIGGLRPRHV
IGAYEDLGMEVVGTGYEFAHNDDYDRTMKEMGDSTLLYDD
VTGYEFEEFVKRIKPDLIGSGIKEKFIFQKMGIPFRQMHS
WDYSGPYHGFDGFAIFARDMDMTLNNPCWKKLQAPWE
B:  SQQVDKIKASYPLFLDQDYKDMLAKKRDGFEEKYPQDKID
EVFQWTTTKEYQELNFQREALTVNPAKACQPLGAVLCALG
FEKTMPYVHGSQGCVAYFRSYFNRHFREPVSCVSDSMTED
AAVFGGQQNMKDGLQNCKATYKPDMIAVSTTCMAEVIGDD
LNAFINNSKKEGFIPDEFPVPFAHTPSFVGSHVTGWDNMF
EGIARYFTLKSMDDKVVGSNKKINIVPGFETYLGNFRVIK
RMLSEMGVGYSLLSDPEEVLDTPADGQFRMYAGGTTQEEM
KDAPNALNTVLLQPWHLEKTKKFVEGTWKHEVPKLNIPMG
LDWTDEFLMKVSEISGQPIPASLTKERGRLVDMMTDSHTW
LHGKRFALWGDPDFVMGLVKFLLELGCEPVHILCHNGNKR
WKKAVDAILAASPYGKNATVYIGKDLWHLRSLVFTDKPDF
MIGNSYGKFIQRDTLHKGKEFEVPLIRIGFPIFDRHHLHR
STTLGYEGAMQILTTLVNSILERLDEETRGMQATDYNHDL
VR
C:  MSREEVESLIQEVLEVYPEKARKDRNKHLAVNDPAVTQSK
KCIISNKKSQPGLMTIRGCAYAGSKGVVWGPIKDMIHISH
GPVGCGQYSRAGRRNYYIGTTGVNAFVTMNFTSDFQEKDI
VFGGDKKLAKLIDEVETLFPLNKGISVQSECPIGLIGDDI
ESVSKVKGAELSKTIVPVRCEGFRGVSQSLGHHIANDAVR
DWVLGKRDEDTTFASTPYDVAIIGDYNIGGDAWSSRILLE
EMGLRCVAQWSGDGSISEIELTPKVKLNLVHCYRSMNYIS
RHMEEKYGIPWMEYNFFGPTKTIESLRAIAAKFDESIQKK
CEEVIAKYKPEWEAVVAKYRPRLEGKRVMLYIGGLRPRHV
IGAYEDLGMEVVGTGYEFAHNDDYDRTMKEMGDSTLLYDD
VTGYEFEEFVKRIKPDLIGSGIKEKFIFQKMGIPFRQMHS
WDYSGPYHGFDGFAIFARDMDMTLNNPCWKKLQAPWE
D:  SQQVDKIKASYPLFLDQDYKDMLAKKRDGFEEKYPQDKID
EVFQWTTTKEYQELNFQREALTVNPAKACQPLGAVLCALG
FEKTMPYVHGSQGCVAYFRSYFNRHFREPVSCVSDSMTED
AAVFGGQQNMKDGLQNCKATYKPDMIAVSTTCMAEVIGDD
LNAFINNSKKEGFIPDEFPVPFAHTPSFVGSHVTGWDNMF
EGIARYFTLKSMDDKVVGSNKKINIVPGFETYLGNFRVIK
RMLSEMGVGYSLLSDPEEVLDTPADGQFRMYAGGTTQEEM
KDAPNALNTVLLQPWHLEKTKKFVEGTWKHEVPKLNIPMG
LDWTDEFLMKVSEISGQPIPASLTKERGRLVDMMTDSHTW
LHGKRFALWGDPDFVMGLVKFLLELGCEPVHILCHNGNKR
WKKAVDAILAASPYGKNATVYIGKDLWHLRSLVFTDKPDF
MIGNSYGKFIQRDTLHKGKEFEVPLIRIGFPIFDRHHLHR
STTLGYEGAMQILTTLVNSILERLDEETRGMQATDYNHDL
VR
Description


Functional site

1) chain A
residue 65
type
sequence A
description binding site for residue HCA A 501
source : AC1

2) chain A
residue 191
type
sequence Q
description binding site for residue HCA A 501
source : AC1

3) chain A
residue 424
type
sequence G
description binding site for residue HCA A 501
source : AC1

4) chain A
residue 425
type
sequence I
description binding site for residue HCA A 501
source : AC1

5) chain A
residue 442
type
sequence H
description binding site for residue HCA A 501
source : AC1

6) chain A
residue 70
type
sequence V
description binding site for residue ICS A 502
source : AC2

7) chain A
residue 96
type
sequence R
description binding site for residue ICS A 502
source : AC2

8) chain A
residue 195
type
sequence H
description binding site for residue ICS A 502
source : AC2

9) chain A
residue 229
type
sequence Y
description binding site for residue ICS A 502
source : AC2

10) chain A
residue 275
type
sequence C
description binding site for residue ICS A 502
source : AC2

11) chain A
residue 356
type
sequence G
description binding site for residue ICS A 502
source : AC2

12) chain A
residue 357
type
sequence G
description binding site for residue ICS A 502
source : AC2

13) chain A
residue 358
type
sequence L
description binding site for residue ICS A 502
source : AC2

14) chain A
residue 359
type
sequence R
description binding site for residue ICS A 502
source : AC2

15) chain A
residue 381
type
sequence F
description binding site for residue ICS A 502
source : AC2

16) chain A
residue 442
type
sequence H
description binding site for residue ICS A 502
source : AC2

17) chain A
residue 294
type
sequence W
description binding site for residue IMD A 503
source : AC3

18) chain A
residue 93
type
sequence R
description binding site for residue CL A 504
source : AC4

19) chain A
residue 111
type
sequence T
description binding site for residue CL A 504
source : AC4

20) chain B
residue 450
type
sequence F
description binding site for residue CL A 504
source : AC4

21) chain B
residue 453
type
sequence R
description binding site for residue CL A 504
source : AC4

22) chain A
residue 62
type
sequence C
description binding site for residue CLF B 601
source : AC5

23) chain A
residue 64
type
sequence Y
description binding site for residue CLF B 601
source : AC5

24) chain A
residue 85
type
sequence P
description binding site for residue CLF B 601
source : AC5

25) chain A
residue 87
type
sequence G
description binding site for residue CLF B 601
source : AC5

26) chain A
residue 88
type
sequence C
description binding site for residue CLF B 601
source : AC5

27) chain A
residue 91
type
sequence Y
description binding site for residue CLF B 601
source : AC5

28) chain A
residue 154
type
sequence C
description binding site for residue CLF B 601
source : AC5

29) chain A
residue 185
type
sequence G
description binding site for residue CLF B 601
source : AC5

30) chain B
residue 70
type
sequence C
description binding site for residue CLF B 601
source : AC5

31) chain B
residue 92
type
sequence S
description binding site for residue CLF B 601
source : AC5

32) chain B
residue 95
type
sequence C
description binding site for residue CLF B 601
source : AC5

33) chain B
residue 98
type
sequence Y
description binding site for residue CLF B 601
source : AC5

34) chain B
residue 153
type
sequence C
description binding site for residue CLF B 601
source : AC5

35) chain B
residue 188
type
sequence S
description binding site for residue CLF B 601
source : AC5

36) chain B
residue 253
type
sequence L
description binding site for residue IMD B 602
source : AC6

37) chain B
residue 256
type
sequence D
description binding site for residue IMD B 602
source : AC6

38) chain B
residue 275
type
sequence G
description binding site for residue IMD B 602
source : AC6

39) chain B
residue 276
type
sequence T
description binding site for residue IMD B 602
source : AC6

40) chain B
residue 280
type
sequence E
description binding site for residue IMD B 602
source : AC6

41) chain B
residue 482
type
sequence S
description binding site for residue IMD B 603
source : AC7

42) chain B
residue 483
type
sequence T
description binding site for residue IMD B 603
source : AC7

43) chain B
residue 492
type
sequence Q
description binding site for residue IMD B 603
source : AC7

44) chain B
residue 496
type
sequence T
description binding site for residue IMD B 603
source : AC7

45) chain A
residue 157
type
sequence G
description binding site for residue IMD B 604
source : AC8

46) chain B
residue 120
type
sequence E
description binding site for residue IMD B 604
source : AC8

47) chain B
residue 123
type
sequence A
description binding site for residue IMD B 604
source : AC8

48) chain C
residue 41
type
sequence Q
description binding site for residue IMD B 604
source : AC8

49) chain C
residue 44
type
sequence K
description binding site for residue IMD B 604
source : AC8

50) chain B
residue 353
type
sequence D
description binding site for residue FE2 B 605
source : AC9

51) chain B
residue 357
type
sequence D
description binding site for residue FE2 B 605
source : AC9

52) chain D
residue 108
type
sequence R
description binding site for residue FE2 B 605
source : AC9

53) chain D
residue 109
type
sequence E
description binding site for residue FE2 B 605
source : AC9

54) chain C
residue 65
type
sequence A
description binding site for residue HCA C 501
source : AD1

55) chain C
residue 191
type
sequence Q
description binding site for residue HCA C 501
source : AD1

56) chain C
residue 424
type
sequence G
description binding site for residue HCA C 501
source : AD1

57) chain C
residue 425
type
sequence I
description binding site for residue HCA C 501
source : AD1

58) chain C
residue 442
type
sequence H
description binding site for residue HCA C 501
source : AD1

59) chain C
residue 70
type
sequence V
description binding site for residue ICS C 502
source : AD2

60) chain C
residue 96
type
sequence R
description binding site for residue ICS C 502
source : AD2

61) chain C
residue 195
type
sequence H
description binding site for residue ICS C 502
source : AD2

62) chain C
residue 229
type
sequence Y
description binding site for residue ICS C 502
source : AD2

63) chain C
residue 275
type
sequence C
description binding site for residue ICS C 502
source : AD2

64) chain C
residue 356
type
sequence G
description binding site for residue ICS C 502
source : AD2

65) chain C
residue 357
type
sequence G
description binding site for residue ICS C 502
source : AD2

66) chain C
residue 358
type
sequence L
description binding site for residue ICS C 502
source : AD2

67) chain C
residue 359
type
sequence R
description binding site for residue ICS C 502
source : AD2

68) chain C
residue 381
type
sequence F
description binding site for residue ICS C 502
source : AD2

69) chain C
residue 442
type
sequence H
description binding site for residue ICS C 502
source : AD2

70) chain C
residue 294
type
sequence W
description binding site for residue IMD C 503
source : AD3

71) chain C
residue 93
type
sequence R
description binding site for residue CL C 504
source : AD4

72) chain C
residue 111
type
sequence T
description binding site for residue CL C 504
source : AD4

73) chain D
residue 450
type
sequence F
description binding site for residue CL C 504
source : AD4

74) chain D
residue 453
type
sequence R
description binding site for residue CL C 504
source : AD4

75) chain C
residue 62
type
sequence C
description binding site for residue CLF D 601
source : AD5

76) chain C
residue 64
type
sequence Y
description binding site for residue CLF D 601
source : AD5

77) chain C
residue 87
type
sequence G
description binding site for residue CLF D 601
source : AD5

78) chain C
residue 88
type
sequence C
description binding site for residue CLF D 601
source : AD5

79) chain C
residue 91
type
sequence Y
description binding site for residue CLF D 601
source : AD5

80) chain C
residue 154
type
sequence C
description binding site for residue CLF D 601
source : AD5

81) chain C
residue 185
type
sequence G
description binding site for residue CLF D 601
source : AD5

82) chain D
residue 70
type
sequence C
description binding site for residue CLF D 601
source : AD5

83) chain D
residue 92
type
sequence S
description binding site for residue CLF D 601
source : AD5

84) chain D
residue 95
type
sequence C
description binding site for residue CLF D 601
source : AD5

85) chain D
residue 98
type
sequence Y
description binding site for residue CLF D 601
source : AD5

86) chain D
residue 153
type
sequence C
description binding site for residue CLF D 601
source : AD5

87) chain D
residue 188
type
sequence S
description binding site for residue CLF D 601
source : AD5

88) chain D
residue 482
type
sequence S
description binding site for residue IMD D 602
source : AD6

89) chain D
residue 483
type
sequence T
description binding site for residue IMD D 602
source : AD6

90) chain D
residue 492
type
sequence Q
description binding site for residue IMD D 602
source : AD6

91) chain D
residue 496
type
sequence T
description binding site for residue IMD D 602
source : AD6

92) chain D
residue 253
type
sequence L
description binding site for residue IMD D 603
source : AD7

93) chain D
residue 256
type
sequence D
description binding site for residue IMD D 603
source : AD7

94) chain D
residue 275
type
sequence G
description binding site for residue IMD D 603
source : AD7

95) chain D
residue 276
type
sequence T
description binding site for residue IMD D 603
source : AD7

96) chain D
residue 280
type
sequence E
description binding site for residue IMD D 603
source : AD7

97) chain A
residue 41
type
sequence Q
description binding site for residue IMD D 604
source : AD8

98) chain A
residue 44
type
sequence K
description binding site for residue IMD D 604
source : AD8

99) chain C
residue 157
type
sequence G
description binding site for residue IMD D 604
source : AD8

100) chain D
residue 120
type
sequence E
description binding site for residue IMD D 604
source : AD8

101) chain D
residue 123
type
sequence A
description binding site for residue IMD D 604
source : AD8

102) chain B
residue 108
type
sequence R
description binding site for residue FE2 D 605
source : AD9

103) chain B
residue 109
type
sequence E
description binding site for residue FE2 D 605
source : AD9

104) chain D
residue 353
type
sequence D
description binding site for residue FE2 D 605
source : AD9

105) chain D
residue 357
type
sequence D
description binding site for residue FE2 D 605
source : AD9

106) chain B
residue 153
type catalytic
sequence C
description 212
source MCSA : MCSA1

107) chain B
residue 157
type catalytic
sequence V
description 212
source MCSA : MCSA1

108) chain A
residue 96
type catalytic
sequence R
description 212
source MCSA : MCSA1

109) chain A
residue 195
type catalytic
sequence H
description 212
source MCSA : MCSA1

110) chain D
residue 153
type catalytic
sequence C
description 212
source MCSA : MCSA2

111) chain D
residue 157
type catalytic
sequence V
description 212
source MCSA : MCSA2

112) chain C
residue 96
type catalytic
sequence R
description 212
source MCSA : MCSA2

113) chain C
residue 195
type catalytic
sequence H
description 212
source MCSA : MCSA2

114) chain A
residue 152-166
type prosite
sequence SECPIGLIGDDIESV
description NITROGENASE_1_2 Nitrogenases component 1 alpha and beta subunits signature 2. SECpigliGDDIeSV
source prosite : PS00090

115) chain B
residue 151-165
type prosite
sequence TTCMAEVIGDDLNAF
description NITROGENASE_1_2 Nitrogenases component 1 alpha and beta subunits signature 2. SECpigliGDDIeSV
source prosite : PS00090

116) chain B
residue 88-95
type prosite
sequence YVHGSQGC
description NITROGENASE_1_1 Nitrogenases component 1 alpha and beta subunits signature 1. ISHGPVGC
source prosite : PS00699

117) chain A
residue 81-88
type prosite
sequence ISHGPVGC
description NITROGENASE_1_1 Nitrogenases component 1 alpha and beta subunits signature 1. ISHGPVGC
source prosite : PS00699

118) chain C
residue 442
type BINDING
sequence H
description
source Swiss-Prot : SWS_FT_FI1

119) chain C
residue 275
type BINDING
sequence C
description
source Swiss-Prot : SWS_FT_FI1

120) chain B
residue 95
type BINDING
sequence C
description
source Swiss-Prot : SWS_FT_FI1

121) chain B
residue 153
type BINDING
sequence C
description
source Swiss-Prot : SWS_FT_FI1

122) chain B
residue 188
type BINDING
sequence S
description
source Swiss-Prot : SWS_FT_FI1

123) chain D
residue 70
type BINDING
sequence C
description
source Swiss-Prot : SWS_FT_FI1

124) chain D
residue 95
type BINDING
sequence C
description
source Swiss-Prot : SWS_FT_FI1

125) chain D
residue 153
type BINDING
sequence C
description
source Swiss-Prot : SWS_FT_FI1

126) chain D
residue 188
type BINDING
sequence S
description
source Swiss-Prot : SWS_FT_FI1

127) chain B
residue 70
type BINDING
sequence C
description
source Swiss-Prot : SWS_FT_FI1


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