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

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Title CO-bound 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 96
type
sequence R
description binding site for residue HCA A 501
source : AC1

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

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

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

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

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

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

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

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

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

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

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

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

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

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

17) chain A
residue 70
type
sequence V
description binding site for residue CMO A 504
source : AC4

18) chain A
residue 195
type
sequence H
description binding site for residue CMO A 504
source : AC4

19) chain A
residue 381
type
sequence F
description binding site for residue CMO A 504
source : AC4

20) chain A
residue 100
type
sequence Y
description binding site for residue CMO A 505
source : AC5

21) chain A
residue 111
type
sequence T
description binding site for residue CMO A 505
source : AC5

22) chain B
residue 453
type
sequence R
description binding site for residue CMO A 505
source : AC5

23) chain A
residue 93
type
sequence R
description binding site for residue ICE A 506
source : AC6

24) chain A
residue 111
type
sequence T
description binding site for residue ICE A 506
source : AC6

25) chain B
residue 450
type
sequence F
description binding site for residue ICE A 506
source : AC6

26) chain B
residue 453
type
sequence R
description binding site for residue ICE A 506
source : AC6

27) chain A
residue 62
type
sequence C
description binding site for residue CLF A 507
source : AC7

28) chain A
residue 64
type
sequence Y
description binding site for residue CLF A 507
source : AC7

29) chain A
residue 87
type
sequence G
description binding site for residue CLF A 507
source : AC7

30) chain A
residue 88
type
sequence C
description binding site for residue CLF A 507
source : AC7

31) chain A
residue 91
type
sequence Y
description binding site for residue CLF A 507
source : AC7

32) chain A
residue 154
type
sequence C
description binding site for residue CLF A 507
source : AC7

33) chain A
residue 185
type
sequence G
description binding site for residue CLF A 507
source : AC7

34) chain B
residue 70
type
sequence C
description binding site for residue CLF A 507
source : AC7

35) chain B
residue 92
type
sequence S
description binding site for residue CLF A 507
source : AC7

36) chain B
residue 95
type
sequence C
description binding site for residue CLF A 507
source : AC7

37) chain B
residue 98
type
sequence Y
description binding site for residue CLF A 507
source : AC7

38) chain B
residue 153
type
sequence C
description binding site for residue CLF A 507
source : AC7

39) chain B
residue 188
type
sequence S
description binding site for residue CLF A 507
source : AC7

40) chain B
residue 253
type
sequence L
description binding site for residue IMD B 601
source : AC8

41) chain B
residue 256
type
sequence D
description binding site for residue IMD B 601
source : AC8

42) chain B
residue 275
type
sequence G
description binding site for residue IMD B 601
source : AC8

43) chain B
residue 276
type
sequence T
description binding site for residue IMD B 601
source : AC8

44) chain B
residue 280
type
sequence E
description binding site for residue IMD B 601
source : AC8

45) chain B
residue 482
type
sequence S
description binding site for residue IMD B 602
source : AC9

46) chain B
residue 483
type
sequence T
description binding site for residue IMD B 602
source : AC9

47) chain B
residue 492
type
sequence Q
description binding site for residue IMD B 602
source : AC9

48) chain B
residue 496
type
sequence T
description binding site for residue IMD B 602
source : AC9

49) chain A
residue 157
type
sequence G
description binding site for residue IMD B 603
source : AD1

50) chain B
residue 120
type
sequence E
description binding site for residue IMD B 603
source : AD1

51) chain B
residue 123
type
sequence A
description binding site for residue IMD B 603
source : AD1

52) chain C
residue 41
type
sequence Q
description binding site for residue IMD B 603
source : AD1

53) chain C
residue 44
type
sequence K
description binding site for residue IMD B 603
source : AD1

54) chain B
residue 466
type
sequence L
description binding site for residue CMO B 604
source : AD2

55) chain B
residue 468
type
sequence R
description binding site for residue CMO B 604
source : AD2

56) chain B
residue 353
type
sequence D
description binding site for residue FE2 B 605
source : AD3

57) chain B
residue 357
type
sequence D
description binding site for residue FE2 B 605
source : AD3

58) chain D
residue 108
type
sequence R
description binding site for residue FE2 B 605
source : AD3

59) chain D
residue 109
type
sequence E
description binding site for residue FE2 B 605
source : AD3

60) chain B
residue 108
type
sequence R
description binding site for residue FE2 B 606
source : AD4

61) chain B
residue 109
type
sequence E
description binding site for residue FE2 B 606
source : AD4

62) chain D
residue 353
type
sequence D
description binding site for residue FE2 B 606
source : AD4

63) chain D
residue 357
type
sequence D
description binding site for residue FE2 B 606
source : AD4

64) chain C
residue 65
type
sequence A
description binding site for residue HCA C 501
source : AD5

65) chain C
residue 96
type
sequence R
description binding site for residue HCA C 501
source : AD5

66) chain C
residue 191
type
sequence Q
description binding site for residue HCA C 501
source : AD5

67) chain C
residue 424
type
sequence G
description binding site for residue HCA C 501
source : AD5

68) chain C
residue 425
type
sequence I
description binding site for residue HCA C 501
source : AD5

69) chain C
residue 442
type
sequence H
description binding site for residue HCA C 501
source : AD5

70) chain C
residue 70
type
sequence V
description binding site for residue ICE C 502
source : AD6

71) chain C
residue 96
type
sequence R
description binding site for residue ICE C 502
source : AD6

72) chain C
residue 229
type
sequence Y
description binding site for residue ICE C 502
source : AD6

73) chain C
residue 275
type
sequence C
description binding site for residue ICE C 502
source : AD6

74) chain C
residue 356
type
sequence G
description binding site for residue ICE C 502
source : AD6

75) chain C
residue 357
type
sequence G
description binding site for residue ICE C 502
source : AD6

76) chain C
residue 358
type
sequence L
description binding site for residue ICE C 502
source : AD6

77) chain C
residue 359
type
sequence R
description binding site for residue ICE C 502
source : AD6

78) chain C
residue 442
type
sequence H
description binding site for residue ICE C 502
source : AD6

79) chain C
residue 294
type
sequence W
description binding site for residue IMD C 503
source : AD7

80) chain C
residue 70
type
sequence V
description binding site for residue CMO C 504
source : AD8

81) chain C
residue 195
type
sequence H
description binding site for residue CMO C 504
source : AD8

82) chain C
residue 381
type
sequence F
description binding site for residue CMO C 504
source : AD8

83) chain C
residue 100
type
sequence Y
description binding site for residue CMO C 505
source : AD9

84) chain C
residue 104
type
sequence T
description binding site for residue CMO C 505
source : AD9

85) chain C
residue 111
type
sequence T
description binding site for residue CMO C 505
source : AD9

86) chain D
residue 453
type
sequence R
description binding site for residue CMO C 505
source : AD9

87) chain C
residue 93
type
sequence R
description binding site for residue ICE C 506
source : AE1

88) chain C
residue 111
type
sequence T
description binding site for residue ICE C 506
source : AE1

89) chain D
residue 450
type
sequence F
description binding site for residue ICE C 506
source : AE1

90) chain D
residue 453
type
sequence R
description binding site for residue ICE C 506
source : AE1

91) chain C
residue 62
type
sequence C
description binding site for residue CLF C 507
source : AE2

92) chain C
residue 64
type
sequence Y
description binding site for residue CLF C 507
source : AE2

93) chain C
residue 85
type
sequence P
description binding site for residue CLF C 507
source : AE2

94) chain C
residue 87
type
sequence G
description binding site for residue CLF C 507
source : AE2

95) chain C
residue 88
type
sequence C
description binding site for residue CLF C 507
source : AE2

96) chain C
residue 91
type
sequence Y
description binding site for residue CLF C 507
source : AE2

97) chain C
residue 154
type
sequence C
description binding site for residue CLF C 507
source : AE2

98) chain C
residue 185
type
sequence G
description binding site for residue CLF C 507
source : AE2

99) chain D
residue 70
type
sequence C
description binding site for residue CLF C 507
source : AE2

100) chain D
residue 92
type
sequence S
description binding site for residue CLF C 507
source : AE2

101) chain D
residue 95
type
sequence C
description binding site for residue CLF C 507
source : AE2

102) chain D
residue 98
type
sequence Y
description binding site for residue CLF C 507
source : AE2

103) chain D
residue 153
type
sequence C
description binding site for residue CLF C 507
source : AE2

104) chain D
residue 188
type
sequence S
description binding site for residue CLF C 507
source : AE2

105) chain D
residue 482
type
sequence S
description binding site for residue IMD D 601
source : AE3

106) chain D
residue 483
type
sequence T
description binding site for residue IMD D 601
source : AE3

107) chain D
residue 492
type
sequence Q
description binding site for residue IMD D 601
source : AE3

108) chain D
residue 496
type
sequence T
description binding site for residue IMD D 601
source : AE3

109) chain D
residue 253
type
sequence L
description binding site for residue IMD D 602
source : AE4

110) chain D
residue 256
type
sequence D
description binding site for residue IMD D 602
source : AE4

111) chain D
residue 275
type
sequence G
description binding site for residue IMD D 602
source : AE4

112) chain D
residue 276
type
sequence T
description binding site for residue IMD D 602
source : AE4

113) chain D
residue 280
type
sequence E
description binding site for residue IMD D 602
source : AE4

114) chain A
residue 41
type
sequence Q
description binding site for residue IMD D 603
source : AE5

115) chain A
residue 44
type
sequence K
description binding site for residue IMD D 603
source : AE5

116) chain C
residue 157
type
sequence G
description binding site for residue IMD D 603
source : AE5

117) chain D
residue 120
type
sequence E
description binding site for residue IMD D 603
source : AE5

118) chain D
residue 466
type
sequence L
description binding site for residue CMO D 604
source : AE6

119) chain D
residue 467
type
sequence I
description binding site for residue CMO D 604
source : AE6

120) chain D
residue 468
type
sequence R
description binding site for residue CMO D 604
source : AE6

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

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

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

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

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

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

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

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

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

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

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

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

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

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

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

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

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

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

139) 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

140) 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

141) 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

142) 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


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