eF-site ID 2j91-ABCD
PDB Code 2j91
Chain A, B, C, D

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Title Crystal structure of Human Adenylosuccinate Lyase in complex with AMP
Classification LYASE
Compound ADENYLOSUCCINATE LYASE
Source Homo sapiens (Human) (PUR8_HUMAN)
Sequence A:  GDHGSPDSYRSPLASRYASPEMCFVFSDRYKFRTWRQLWL
WLAEAEQTLGLPITDEQIREMKSNLENIDFKMAAEEEKRL
RHDVMAHVHTFGHCCPKAAGIIHLGATSCYVGDNTDLIIL
RNALDLLLPKLARVISRLADFAKERASLPTLGFTHFQPAQ
LTTVGKRCCLWIQDLCMDLQNLKRVRDDLRFRGVKGTTGT
QASFLQLFEGDDHKVEQLDKMVTEKAGFKRAFIITGQTYT
RKVDIEVLSVLASLGASVHKICTDIRLLANLKEMEEPFYK
RNPMRSERCCSLARHLMTLVMDPLQTASVQWFERTLDDSA
NRRICLAEAFLTADTILNTLQNISEGLVVYPKVIERRIRQ
ELPFMATENIIMAMVGGSRQDCHEKIRVLSQQAASVVKQE
GGDNDLIERIQVDAYFSPIHSQLDHLLDPSSFTGRASQQV
QRFLEEEVYPLLKPYES
B:  GDHGSPDSYRSPLASRYASPEMCFVFSDRYKFRTWRQLWL
WLAEAEQTLGLPITDEQIREMKSNLENIDFKMAAEEEKRL
RHDVMAHVHTFGHCCAAGIIHLGATSCYVGDNTDLIILRN
ALDLLLPKLARVISRLADFAKERASLPTLGFTHFQPAQLT
TVGKRCCLWIQDLCMDLQNLKRVRDDLRFRGVKGTTGTQA
SFLQLFEGDDHKVEQLDKMVTEKAGFKRAFIITGQTYTRK
VDIEVLSVLASLGASVHKICTDIRLLANLKEMEEPFMPYK
RNPMRSERCCSLARHLMTLVMDPLQTASVQWFERTLDDSA
NRRICLAEAFLTADTILNTLQNISEGLVVYPKVIERRIRQ
ELPFMATENIIMAMVKAGGSRQDCHEKIRVLSQQAASVVK
QEGGDNDLIERIQVDAYFSPIHSQLDHLLDPSSFTGRASQ
QVQRFLEEEVYPLLKPYESVKAE
C:  GDHGSPDSYRSPLASRYASPEMCFVFSDRYKFRTWRQLWL
WLAEAEQTLGLPITDEQIREMKSNLENIDFKMAAEEEKRL
RHDVMAHVHTFGHCCPKAAGIIHLGATSCYVGDNTDLIIL
RNALDLLLPKLARVISRLADFAKERASLPTLGFTHFQPAQ
LTTVGKRCCLWIQDLCMDLQNLKRVRDDLRFRGVKGTTGT
QASFLQLFEGDDHKVEQLDKMVTEKAGFKRAFIITGQTYT
RKVDIEVLSVLASLGASVHKICTDIRLLANLKEMEEPYKR
NPMRSERCCSLARHLMTLVMDPLQTASVQWFERTLDDSAN
RRICLAEAFLTADTILNTLQNISEGLVVYPKVIERRIRQE
LPFMATENIIMAMVKAGGSRQDCHEKIRVLSQQAASVVKQ
EGGDNDLIERIQVDAYFSPIHSQLDHLLDPSSFTGRASQQ
VQRFLEEEVYPLLKPY
D:  GDHGSPDSYRSPLASRYASPEMCFVFSDRYKFRTWRQLWL
WLAEAEQTLGLPITIREMKSNLENIDFKMAAEEEKRLRHD
VMAHVHTFGHCCPKAAGIIHLGATSCYVGDNTDLIILRNA
LDLLLPKLARVISRLADFAKERASLPTLGFTHFQPAQLTT
VGKRCCLWIQDLCMDLQNLKRVRDDLRFRGVKGTTGTQAS
FLQLFEGDDHKVEQLDKMVTEKAGFKRAFIITGQTYTRKV
DIEVLSVLASLGASVHKICTDIRLLANLKEMEEPFPYKRN
PMRSERCCSLARHLMTLVMDPLQTASVQWFERTLDDSANR
RICLAEAFLTADTILNTLQNISEGLVVYPKVIERRIRQEL
PFMATENIIMAMVKAGGSRQDCHEKIRVLSQQAASVVKQE
GGDNDLIERIQVDAYFSPIHSQLDHLLDPSSFTGRASQQV
QRFLEEEVYPLLKPYE
Description


Functional site

1) chain A
residue 111
type
sequence T
description BINDING SITE FOR RESIDUE CL A1001
source : AC1

2) chain A
residue 114
type
sequence Y
description BINDING SITE FOR RESIDUE CL A1001
source : AC1

3) chain A
residue 196
type
sequence R
description BINDING SITE FOR RESIDUE CL A1001
source : AC1

4) chain A
residue 199
type
sequence K
description BINDING SITE FOR RESIDUE CL A1001
source : AC1

5) chain A
residue 200
type
sequence G
description BINDING SITE FOR RESIDUE CL A1001
source : AC1

6) chain B
residue 111
type
sequence T
description BINDING SITE FOR RESIDUE CL B1001
source : AC2

7) chain B
residue 196
type
sequence R
description BINDING SITE FOR RESIDUE CL B1001
source : AC2

8) chain B
residue 199
type
sequence K
description BINDING SITE FOR RESIDUE CL B1001
source : AC2

9) chain B
residue 200
type
sequence G
description BINDING SITE FOR RESIDUE CL B1001
source : AC2

10) chain C
residue 111
type
sequence T
description BINDING SITE FOR RESIDUE CL C1001
source : AC3

11) chain C
residue 114
type
sequence Y
description BINDING SITE FOR RESIDUE CL C1001
source : AC3

12) chain C
residue 196
type
sequence R
description BINDING SITE FOR RESIDUE CL C1001
source : AC3

13) chain C
residue 199
type
sequence K
description BINDING SITE FOR RESIDUE CL C1001
source : AC3

14) chain C
residue 200
type
sequence G
description BINDING SITE FOR RESIDUE CL C1001
source : AC3

15) chain D
residue 111
type
sequence T
description BINDING SITE FOR RESIDUE CL D1001
source : AC4

16) chain D
residue 114
type
sequence Y
description BINDING SITE FOR RESIDUE CL D1001
source : AC4

17) chain D
residue 196
type
sequence R
description BINDING SITE FOR RESIDUE CL D1001
source : AC4

18) chain D
residue 199
type
sequence K
description BINDING SITE FOR RESIDUE CL D1001
source : AC4

19) chain D
residue 200
type
sequence G
description BINDING SITE FOR RESIDUE CL D1001
source : AC4

20) chain A
residue 20
type
sequence R
description BINDING SITE FOR RESIDUE AMP A1000
source : AC5

21) chain A
residue 21
type
sequence Y
description BINDING SITE FOR RESIDUE AMP A1000
source : AC5

22) chain A
residue 299
type
sequence M
description BINDING SITE FOR RESIDUE AMP A1000
source : AC5

23) chain A
residue 303
type
sequence R
description BINDING SITE FOR RESIDUE AMP A1000
source : AC5

24) chain C
residue 159
type
sequence H
description BINDING SITE FOR RESIDUE AMP A1000
source : AC5

25) chain D
residue 85
type
sequence R
description BINDING SITE FOR RESIDUE AMP A1000
source : AC5

26) chain D
residue 86
type
sequence H
description BINDING SITE FOR RESIDUE AMP A1000
source : AC5

27) chain D
residue 87
type
sequence D
description BINDING SITE FOR RESIDUE AMP A1000
source : AC5

28) chain D
residue 241
type
sequence Q
description BINDING SITE FOR RESIDUE AMP A1000
source : AC5

29) chain D
residue 329
type
sequence R
description BINDING SITE FOR RESIDUE AMP A1000
source : AC5

30) chain D
residue 331
type
sequence L
description BINDING SITE FOR RESIDUE AMP A1000
source : AC5

31) chain D
residue 334
type
sequence S
description BINDING SITE FOR RESIDUE AMP A1000
source : AC5

32) chain D
residue 335
type
sequence A
description BINDING SITE FOR RESIDUE AMP A1000
source : AC5

33) chain D
residue 338
type
sequence R
description BINDING SITE FOR RESIDUE AMP A1000
source : AC5

34) chain B
residue 20
type
sequence R
description BINDING SITE FOR RESIDUE AMP B1000
source : AC6

35) chain B
residue 21
type
sequence Y
description BINDING SITE FOR RESIDUE AMP B1000
source : AC6

36) chain B
residue 299
type
sequence M
description BINDING SITE FOR RESIDUE AMP B1000
source : AC6

37) chain B
residue 303
type
sequence R
description BINDING SITE FOR RESIDUE AMP B1000
source : AC6

38) chain C
residue 85
type
sequence R
description BINDING SITE FOR RESIDUE AMP B1000
source : AC6

39) chain C
residue 86
type
sequence H
description BINDING SITE FOR RESIDUE AMP B1000
source : AC6

40) chain C
residue 87
type
sequence D
description BINDING SITE FOR RESIDUE AMP B1000
source : AC6

41) chain C
residue 112
type
sequence S
description BINDING SITE FOR RESIDUE AMP B1000
source : AC6

42) chain C
residue 241
type
sequence Q
description BINDING SITE FOR RESIDUE AMP B1000
source : AC6

43) chain C
residue 329
type
sequence R
description BINDING SITE FOR RESIDUE AMP B1000
source : AC6

44) chain C
residue 331
type
sequence L
description BINDING SITE FOR RESIDUE AMP B1000
source : AC6

45) chain C
residue 334
type
sequence S
description BINDING SITE FOR RESIDUE AMP B1000
source : AC6

46) chain C
residue 335
type
sequence A
description BINDING SITE FOR RESIDUE AMP B1000
source : AC6

47) chain C
residue 338
type
sequence R
description BINDING SITE FOR RESIDUE AMP B1000
source : AC6

48) chain D
residue 159
type
sequence H
description BINDING SITE FOR RESIDUE AMP B1000
source : AC6

49) chain A
residue 159
type
sequence H
description BINDING SITE FOR RESIDUE AMP C1000
source : AC7

50) chain B
residue 85
type
sequence R
description BINDING SITE FOR RESIDUE AMP C1000
source : AC7

51) chain B
residue 87
type
sequence D
description BINDING SITE FOR RESIDUE AMP C1000
source : AC7

52) chain B
residue 241
type
sequence Q
description BINDING SITE FOR RESIDUE AMP C1000
source : AC7

53) chain B
residue 329
type
sequence R
description BINDING SITE FOR RESIDUE AMP C1000
source : AC7

54) chain B
residue 334
type
sequence S
description BINDING SITE FOR RESIDUE AMP C1000
source : AC7

55) chain B
residue 335
type
sequence A
description BINDING SITE FOR RESIDUE AMP C1000
source : AC7

56) chain B
residue 338
type
sequence R
description BINDING SITE FOR RESIDUE AMP C1000
source : AC7

57) chain C
residue 20
type
sequence R
description BINDING SITE FOR RESIDUE AMP C1000
source : AC7

58) chain C
residue 21
type
sequence Y
description BINDING SITE FOR RESIDUE AMP C1000
source : AC7

59) chain C
residue 299
type
sequence M
description BINDING SITE FOR RESIDUE AMP C1000
source : AC7

60) chain C
residue 303
type
sequence R
description BINDING SITE FOR RESIDUE AMP C1000
source : AC7

61) chain A
residue 85
type
sequence R
description BINDING SITE FOR RESIDUE AMP D1000
source : AC8

62) chain A
residue 86
type
sequence H
description BINDING SITE FOR RESIDUE AMP D1000
source : AC8

63) chain A
residue 87
type
sequence D
description BINDING SITE FOR RESIDUE AMP D1000
source : AC8

64) chain A
residue 112
type
sequence S
description BINDING SITE FOR RESIDUE AMP D1000
source : AC8

65) chain A
residue 241
type
sequence Q
description BINDING SITE FOR RESIDUE AMP D1000
source : AC8

66) chain A
residue 329
type
sequence R
description BINDING SITE FOR RESIDUE AMP D1000
source : AC8

67) chain A
residue 331
type
sequence L
description BINDING SITE FOR RESIDUE AMP D1000
source : AC8

68) chain A
residue 334
type
sequence S
description BINDING SITE FOR RESIDUE AMP D1000
source : AC8

69) chain A
residue 335
type
sequence A
description BINDING SITE FOR RESIDUE AMP D1000
source : AC8

70) chain A
residue 338
type
sequence R
description BINDING SITE FOR RESIDUE AMP D1000
source : AC8

71) chain B
residue 159
type
sequence H
description BINDING SITE FOR RESIDUE AMP D1000
source : AC8

72) chain B
residue 481
type
sequence E
description BINDING SITE FOR RESIDUE AMP D1000
source : AC8

73) chain D
residue 20
type
sequence R
description BINDING SITE FOR RESIDUE AMP D1000
source : AC8

74) chain D
residue 21
type
sequence Y
description BINDING SITE FOR RESIDUE AMP D1000
source : AC8

75) chain D
residue 299
type
sequence M
description BINDING SITE FOR RESIDUE AMP D1000
source : AC8

76) chain D
residue 303
type
sequence R
description BINDING SITE FOR RESIDUE AMP D1000
source : AC8

77) chain A
residue 35
type
sequence K
description BINDING SITE FOR RESIDUE GOL A1475
source : AC9

78) chain A
residue 39
type
sequence W
description BINDING SITE FOR RESIDUE GOL A1475
source : AC9

79) chain A
residue 87
type
sequence D
description BINDING SITE FOR RESIDUE GOL A1475
source : AC9

80) chain A
residue 116
type
sequence G
description BINDING SITE FOR RESIDUE GOL A1475
source : AC9

81) chain A
residue 120
type
sequence D
description BINDING SITE FOR RESIDUE GOL A1475
source : AC9

82) chain A
residue 334
type
sequence S
description BINDING SITE FOR RESIDUE GOL A1475
source : AC9

83) chain A
residue 338
type
sequence R
description BINDING SITE FOR RESIDUE GOL A1475
source : AC9

84) chain B
residue 30
type
sequence F
description BINDING SITE FOR RESIDUE GOL B1482
source : BC1

85) chain B
residue 120
type
sequence D
description BINDING SITE FOR RESIDUE GOL B1482
source : BC1

86) chain B
residue 337
type
sequence R
description BINDING SITE FOR RESIDUE GOL B1482
source : BC1

87) chain B
residue 338
type
sequence R
description BINDING SITE FOR RESIDUE GOL B1482
source : BC1

88) chain B
residue 341
type
sequence L
description BINDING SITE FOR RESIDUE GOL B1482
source : BC1

89) chain B
residue 342
type
sequence A
description BINDING SITE FOR RESIDUE GOL B1482
source : BC1

90) chain C
residue 35
type
sequence K
description BINDING SITE FOR RESIDUE GOL C1473
source : BC2

91) chain C
residue 39
type
sequence W
description BINDING SITE FOR RESIDUE GOL C1473
source : BC2

92) chain C
residue 87
type
sequence D
description BINDING SITE FOR RESIDUE GOL C1473
source : BC2

93) chain C
residue 116
type
sequence G
description BINDING SITE FOR RESIDUE GOL C1473
source : BC2

94) chain C
residue 120
type
sequence D
description BINDING SITE FOR RESIDUE GOL C1473
source : BC2

95) chain C
residue 334
type
sequence S
description BINDING SITE FOR RESIDUE GOL C1473
source : BC2

96) chain C
residue 338
type
sequence R
description BINDING SITE FOR RESIDUE GOL C1473
source : BC2

97) chain B
residue 161
type
sequence Q
description BINDING SITE FOR RESIDUE GOL D1474
source : BC3

98) chain B
residue 415
type
sequence K
description BINDING SITE FOR RESIDUE GOL D1474
source : BC3

99) chain D
residue 276
type
sequence K
description BINDING SITE FOR RESIDUE GOL D1474
source : BC3

100) chain D
residue 294
type
sequence Y
description BINDING SITE FOR RESIDUE GOL D1474
source : BC3

101) chain D
residue 295
type
sequence K
description BINDING SITE FOR RESIDUE GOL D1474
source : BC3

102) chain D
residue 296
type
sequence R
description BINDING SITE FOR RESIDUE GOL D1474
source : BC3

103) chain A
residue 159
type ACT_SITE
sequence H
description Proton donor/acceptor => ECO:0000269|PubMed:22812634
source Swiss-Prot : SWS_FT_FI1

104) chain B
residue 159
type ACT_SITE
sequence H
description Proton donor/acceptor => ECO:0000269|PubMed:22812634
source Swiss-Prot : SWS_FT_FI1

105) chain C
residue 159
type ACT_SITE
sequence H
description Proton donor/acceptor => ECO:0000269|PubMed:22812634
source Swiss-Prot : SWS_FT_FI1

106) chain D
residue 159
type ACT_SITE
sequence H
description Proton donor/acceptor => ECO:0000269|PubMed:22812634
source Swiss-Prot : SWS_FT_FI1

107) chain A
residue 147
type MOD_RES
sequence K
description N6-acetyllysine => ECO:0007744|PubMed:19608861
source Swiss-Prot : SWS_FT_FI5

108) chain A
residue 295
type MOD_RES
sequence K
description N6-acetyllysine => ECO:0007744|PubMed:19608861
source Swiss-Prot : SWS_FT_FI5

109) chain B
residue 147
type MOD_RES
sequence K
description N6-acetyllysine => ECO:0007744|PubMed:19608861
source Swiss-Prot : SWS_FT_FI5

110) chain B
residue 295
type MOD_RES
sequence K
description N6-acetyllysine => ECO:0007744|PubMed:19608861
source Swiss-Prot : SWS_FT_FI5

111) chain C
residue 147
type MOD_RES
sequence K
description N6-acetyllysine => ECO:0007744|PubMed:19608861
source Swiss-Prot : SWS_FT_FI5

112) chain C
residue 295
type MOD_RES
sequence K
description N6-acetyllysine => ECO:0007744|PubMed:19608861
source Swiss-Prot : SWS_FT_FI5

113) chain D
residue 147
type MOD_RES
sequence K
description N6-acetyllysine => ECO:0007744|PubMed:19608861
source Swiss-Prot : SWS_FT_FI5

114) chain D
residue 295
type MOD_RES
sequence K
description N6-acetyllysine => ECO:0007744|PubMed:19608861
source Swiss-Prot : SWS_FT_FI5

115) chain A
residue 415
type CROSSLNK
sequence K
description Glycyl lysine isopeptide (Lys-Gly) (interchain with G-Cter in SUMO1) => ECO:0007744|PubMed:25114211
source Swiss-Prot : SWS_FT_FI6

116) chain B
residue 415
type CROSSLNK
sequence K
description Glycyl lysine isopeptide (Lys-Gly) (interchain with G-Cter in SUMO1) => ECO:0007744|PubMed:25114211
source Swiss-Prot : SWS_FT_FI6

117) chain C
residue 415
type CROSSLNK
sequence K
description Glycyl lysine isopeptide (Lys-Gly) (interchain with G-Cter in SUMO1) => ECO:0007744|PubMed:25114211
source Swiss-Prot : SWS_FT_FI6

118) chain D
residue 415
type CROSSLNK
sequence K
description Glycyl lysine isopeptide (Lys-Gly) (interchain with G-Cter in SUMO1) => ECO:0007744|PubMed:25114211
source Swiss-Prot : SWS_FT_FI6

119) chain A
residue 20
type BINDING
sequence R
description
source Swiss-Prot : SWS_FT_FI2

120) chain A
residue 303
type BINDING
sequence R
description
source Swiss-Prot : SWS_FT_FI2

121) chain B
residue 20
type BINDING
sequence R
description
source Swiss-Prot : SWS_FT_FI2

122) chain B
residue 303
type BINDING
sequence R
description
source Swiss-Prot : SWS_FT_FI2

123) chain C
residue 20
type BINDING
sequence R
description
source Swiss-Prot : SWS_FT_FI2

124) chain C
residue 303
type BINDING
sequence R
description
source Swiss-Prot : SWS_FT_FI2

125) chain D
residue 20
type BINDING
sequence R
description
source Swiss-Prot : SWS_FT_FI2

126) chain D
residue 303
type BINDING
sequence R
description
source Swiss-Prot : SWS_FT_FI2

127) chain A
residue 85
type BINDING
sequence R
description in other chain
source Swiss-Prot : SWS_FT_FI3

128) chain B
residue 329
type BINDING
sequence R
description in other chain
source Swiss-Prot : SWS_FT_FI3

129) chain B
residue 334
type BINDING
sequence S
description in other chain
source Swiss-Prot : SWS_FT_FI3

130) chain B
residue 338
type BINDING
sequence R
description in other chain
source Swiss-Prot : SWS_FT_FI3

131) chain C
residue 85
type BINDING
sequence R
description in other chain
source Swiss-Prot : SWS_FT_FI3

132) chain C
residue 111
type BINDING
sequence T
description in other chain
source Swiss-Prot : SWS_FT_FI3

133) chain C
residue 241
type BINDING
sequence Q
description in other chain
source Swiss-Prot : SWS_FT_FI3

134) chain C
residue 329
type BINDING
sequence R
description in other chain
source Swiss-Prot : SWS_FT_FI3

135) chain C
residue 334
type BINDING
sequence S
description in other chain
source Swiss-Prot : SWS_FT_FI3

136) chain C
residue 338
type BINDING
sequence R
description in other chain
source Swiss-Prot : SWS_FT_FI3

137) chain D
residue 85
type BINDING
sequence R
description in other chain
source Swiss-Prot : SWS_FT_FI3

138) chain A
residue 111
type BINDING
sequence T
description in other chain
source Swiss-Prot : SWS_FT_FI3

139) chain D
residue 111
type BINDING
sequence T
description in other chain
source Swiss-Prot : SWS_FT_FI3

140) chain D
residue 241
type BINDING
sequence Q
description in other chain
source Swiss-Prot : SWS_FT_FI3

141) chain D
residue 329
type BINDING
sequence R
description in other chain
source Swiss-Prot : SWS_FT_FI3

142) chain D
residue 334
type BINDING
sequence S
description in other chain
source Swiss-Prot : SWS_FT_FI3

143) chain D
residue 338
type BINDING
sequence R
description in other chain
source Swiss-Prot : SWS_FT_FI3

144) chain A
residue 241
type BINDING
sequence Q
description in other chain
source Swiss-Prot : SWS_FT_FI3

145) chain A
residue 329
type BINDING
sequence R
description in other chain
source Swiss-Prot : SWS_FT_FI3

146) chain A
residue 334
type BINDING
sequence S
description in other chain
source Swiss-Prot : SWS_FT_FI3

147) chain A
residue 338
type BINDING
sequence R
description in other chain
source Swiss-Prot : SWS_FT_FI3

148) chain B
residue 85
type BINDING
sequence R
description in other chain
source Swiss-Prot : SWS_FT_FI3

149) chain B
residue 111
type BINDING
sequence T
description in other chain
source Swiss-Prot : SWS_FT_FI3

150) chain B
residue 241
type BINDING
sequence Q
description in other chain
source Swiss-Prot : SWS_FT_FI3


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