eF-site ID 5al1-AB
PDB Code 5al1
Chain A, B

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Title Crystal structure of TNKS2 in complex with 2-(4-tert-butylphenyl)-1H, 2H,3H,4H-pyrido(2,3-d)pyrimidin-4-one
Classification TRANSFERASE
Compound TANKYRASE 2
Source Homo sapiens (Human) (TNKS2_HUMAN)
Sequence A:  GTILIDLSPDDKEFQSVEEEMQSTVREHRDGGHAGGIFNR
YNILKIQKVCNKKLWERYTHRRKEVSEENHNHANERMLFH
GSPFVNAIIHKGFDERHAYIGGMFGAGIYFAENSSKSNQY
VYGIGGGTGCPVHKDRSCYICHRQLLFCRVTLGKSFLQFS
AMAHSPPGHHSVTGRPSVNGLALAEYVIYRGEQAYPEYLI
TYQIMRPE
B:  GTILIDLSPDDKEFQSVEEEMQSTVREHRDGGHAGGIFNR
YNILKIQKVCNKKLWERYTHRRKEVSEENHNHANERMLFH
GSPFVNAIIHKGFDERHAYIGGMFGAGIYFAENSSKSNQY
VYGIGGGTGCPVHKDRSCYICHRQLLFCRVTLGKSFLQFS
AMKMAHSPPGHHSVTGRPSVNGLALAEYVIYRGEQAYPEY
LITYQIMRPE
Description


Functional site

1) chain A
residue 977
type
sequence R
description BINDING SITE FOR RESIDUE SO4 A 2162
source : AC1

2) chain A
residue 979
type
sequence H
description BINDING SITE FOR RESIDUE SO4 A 2162
source : AC1

3) chain A
residue 980
type
sequence R
description BINDING SITE FOR RESIDUE SO4 A 2162
source : AC1

4) chain A
residue 1067
type
sequence K
description BINDING SITE FOR RESIDUE SO4 A 2162
source : AC1

5) chain A
residue 1070
type
sequence Q
description BINDING SITE FOR RESIDUE SO4 A 2162
source : AC1

6) chain A
residue 990
type
sequence N
description BINDING SITE FOR RESIDUE SO4 A 2163
source : AC2

7) chain A
residue 991
type
sequence R
description BINDING SITE FOR RESIDUE SO4 A 2163
source : AC2

8) chain A
residue 1160
type
sequence P
description BINDING SITE FOR RESIDUE SO4 A 2163
source : AC2

9) chain A
residue 1161
type
sequence E
description BINDING SITE FOR RESIDUE SO4 A 2163
source : AC2

10) chain A
residue 1081
type
sequence C
description BINDING SITE FOR RESIDUE ZN A 2164
source : AC3

11) chain A
residue 1084
type
sequence H
description BINDING SITE FOR RESIDUE ZN A 2164
source : AC3

12) chain A
residue 1089
type
sequence C
description BINDING SITE FOR RESIDUE ZN A 2164
source : AC3

13) chain A
residue 1092
type
sequence C
description BINDING SITE FOR RESIDUE ZN A 2164
source : AC3

14) chain A
residue 1128
type
sequence R
description BINDING SITE FOR RESIDUE GOL A 2165
source : AC4

15) chain A
residue 1129
type
sequence P
description BINDING SITE FOR RESIDUE GOL A 2165
source : AC4

16) chain A
residue 1129
type
sequence P
description BINDING SITE FOR RESIDUE GOL A 2165
source : AC4

17) chain A
residue 1130
type
sequence S
description BINDING SITE FOR RESIDUE GOL A 2165
source : AC4

18) chain A
residue 1131
type
sequence V
description BINDING SITE FOR RESIDUE GOL A 2165
source : AC4

19) chain A
residue 1132
type
sequence N
description BINDING SITE FOR RESIDUE GOL A 2165
source : AC4

20) chain A
residue 1133
type
sequence G
description BINDING SITE FOR RESIDUE GOL A 2165
source : AC4

21) chain A
residue 978
type
sequence E
description BINDING SITE FOR RESIDUE GOL A 2166
source : AC5

22) chain A
residue 979
type
sequence H
description BINDING SITE FOR RESIDUE GOL A 2166
source : AC5

23) chain A
residue 982
type
sequence G
description BINDING SITE FOR RESIDUE GOL A 2166
source : AC5

24) chain A
residue 983
type
sequence G
description BINDING SITE FOR RESIDUE GOL A 2166
source : AC5

25) chain A
residue 988
type
sequence I
description BINDING SITE FOR RESIDUE GOL A 2166
source : AC5

26) chain A
residue 989
type
sequence F
description BINDING SITE FOR RESIDUE GOL A 2166
source : AC5

27) chain A
residue 1031
type
sequence H
description BINDING SITE FOR RESIDUE GN5 A 2167
source : AC6

28) chain A
residue 1032
type
sequence G
description BINDING SITE FOR RESIDUE GN5 A 2167
source : AC6

29) chain A
residue 1050
type
sequence Y
description BINDING SITE FOR RESIDUE GN5 A 2167
source : AC6

30) chain A
residue 1060
type
sequence Y
description BINDING SITE FOR RESIDUE GN5 A 2167
source : AC6

31) chain A
residue 1061
type
sequence F
description BINDING SITE FOR RESIDUE GN5 A 2167
source : AC6

32) chain A
residue 1062
type
sequence A
description BINDING SITE FOR RESIDUE GN5 A 2167
source : AC6

33) chain A
residue 1067
type
sequence K
description BINDING SITE FOR RESIDUE GN5 A 2167
source : AC6

34) chain A
residue 1068
type
sequence S
description BINDING SITE FOR RESIDUE GN5 A 2167
source : AC6

35) chain A
residue 1071
type
sequence Y
description BINDING SITE FOR RESIDUE GN5 A 2167
source : AC6

36) chain A
residue 1138
type
sequence E
description BINDING SITE FOR RESIDUE GN5 A 2167
source : AC6

37) chain B
residue 977
type
sequence R
description BINDING SITE FOR RESIDUE SO4 B 2162
source : AC7

38) chain B
residue 979
type
sequence H
description BINDING SITE FOR RESIDUE SO4 B 2162
source : AC7

39) chain B
residue 980
type
sequence R
description BINDING SITE FOR RESIDUE SO4 B 2162
source : AC7

40) chain B
residue 1067
type
sequence K
description BINDING SITE FOR RESIDUE SO4 B 2162
source : AC7

41) chain B
residue 1070
type
sequence Q
description BINDING SITE FOR RESIDUE SO4 B 2162
source : AC7

42) chain B
residue 990
type
sequence N
description BINDING SITE FOR RESIDUE SO4 B 2163
source : AC8

43) chain B
residue 991
type
sequence R
description BINDING SITE FOR RESIDUE SO4 B 2163
source : AC8

44) chain B
residue 1160
type
sequence P
description BINDING SITE FOR RESIDUE SO4 B 2163
source : AC8

45) chain B
residue 1161
type
sequence E
description BINDING SITE FOR RESIDUE SO4 B 2163
source : AC8

46) chain B
residue 1081
type
sequence C
description BINDING SITE FOR RESIDUE ZN B 2164
source : AC9

47) chain B
residue 1084
type
sequence H
description BINDING SITE FOR RESIDUE ZN B 2164
source : AC9

48) chain B
residue 1089
type
sequence C
description BINDING SITE FOR RESIDUE ZN B 2164
source : AC9

49) chain B
residue 1092
type
sequence C
description BINDING SITE FOR RESIDUE ZN B 2164
source : AC9

50) chain B
residue 978
type
sequence E
description BINDING SITE FOR RESIDUE GOL B 2165
source : BC1

51) chain B
residue 979
type
sequence H
description BINDING SITE FOR RESIDUE GOL B 2165
source : BC1

52) chain B
residue 982
type
sequence G
description BINDING SITE FOR RESIDUE GOL B 2165
source : BC1

53) chain B
residue 983
type
sequence G
description BINDING SITE FOR RESIDUE GOL B 2165
source : BC1

54) chain B
residue 988
type
sequence I
description BINDING SITE FOR RESIDUE GOL B 2165
source : BC1

55) chain B
residue 989
type
sequence F
description BINDING SITE FOR RESIDUE GOL B 2165
source : BC1

56) chain B
residue 1031
type
sequence H
description BINDING SITE FOR RESIDUE GN5 B 2166
source : BC2

57) chain B
residue 1032
type
sequence G
description BINDING SITE FOR RESIDUE GN5 B 2166
source : BC2

58) chain B
residue 1035
type
sequence F
description BINDING SITE FOR RESIDUE GN5 B 2166
source : BC2

59) chain B
residue 1050
type
sequence Y
description BINDING SITE FOR RESIDUE GN5 B 2166
source : BC2

60) chain B
residue 1060
type
sequence Y
description BINDING SITE FOR RESIDUE GN5 B 2166
source : BC2

61) chain B
residue 1061
type
sequence F
description BINDING SITE FOR RESIDUE GN5 B 2166
source : BC2

62) chain B
residue 1062
type
sequence A
description BINDING SITE FOR RESIDUE GN5 B 2166
source : BC2

63) chain B
residue 1068
type
sequence S
description BINDING SITE FOR RESIDUE GN5 B 2166
source : BC2

64) chain B
residue 1071
type
sequence Y
description BINDING SITE FOR RESIDUE GN5 B 2166
source : BC2

65) chain B
residue 1075
type
sequence I
description BINDING SITE FOR RESIDUE GN5 B 2166
source : BC2

66) chain B
residue 1138
type
sequence E
description BINDING SITE FOR RESIDUE GN5 B 2166
source : BC2

67) chain A
residue 1081
type BINDING
sequence C
description BINDING => ECO:0000250|UniProtKB:O95271
source Swiss-Prot : SWS_FT_FI1

68) chain A
residue 1084
type BINDING
sequence H
description BINDING => ECO:0000250|UniProtKB:O95271
source Swiss-Prot : SWS_FT_FI1

69) chain A
residue 1089
type BINDING
sequence C
description BINDING => ECO:0000250|UniProtKB:O95271
source Swiss-Prot : SWS_FT_FI1

70) chain A
residue 1092
type BINDING
sequence C
description BINDING => ECO:0000250|UniProtKB:O95271
source Swiss-Prot : SWS_FT_FI1

71) chain B
residue 1081
type BINDING
sequence C
description BINDING => ECO:0000250|UniProtKB:O95271
source Swiss-Prot : SWS_FT_FI1

72) chain B
residue 1084
type BINDING
sequence H
description BINDING => ECO:0000250|UniProtKB:O95271
source Swiss-Prot : SWS_FT_FI1

73) chain B
residue 1089
type BINDING
sequence C
description BINDING => ECO:0000250|UniProtKB:O95271
source Swiss-Prot : SWS_FT_FI1

74) chain B
residue 1092
type BINDING
sequence C
description BINDING => ECO:0000250|UniProtKB:O95271
source Swiss-Prot : SWS_FT_FI1


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