eF-site ID 4zl4-AB
PDB Code 4zl4
Chain A, B

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Title Plasmepsin V from Plasmodium vivax bound to a transition state mimetic (WEHI-842)
Classification hydrolase/hydrolase inhibitor
Compound Aspartic protease PM5
Source (Q6PRR9_PLAVI)
Sequence A:  KDLLYKYKLYGDIDEYAYYFLDIDIGTPEQRISLILDTGS
SSLSFPCAGCKNCGVHMENPFNLNNSKTSSILYCENEECP
FKLNCVKGKCEYMQSYCEGSQISGFYFSDVVSVVSYNNER
VTFRKLMGCHMHEESLFLYQQATGVLGMSLSKPQGIPTFV
NLLFDNAPQLKQVFTICISENGGELIAGGYDPAYIVRAEK
VVWENVTRKYYYYIKVRGLDMFGTNMMSSSKGLEMLVDSG
STFTHIPEDLYNKLNYFFDILCIQDMNNAYDVNKRLKMTN
ESFNNPLVQFDDFRKSLKSIIAKENMCVKIVDGVQCWKYL
EGLPDLFVTLSNNYKMKWQPHSYLYKKESFWCKGIEKQVN
NKPILGLTFFKNRQVIFDIQKNRIGFVDANCPSHP
B:  KDLLYKYKLYGDIDEYAYYFLDIDIGTPEQRISLILDTGS
SSLSFPCAGCKNCGVHMENPFNLNNSKTSSILYCENEECP
FKLNCVKGKCEYMQSYCEGSQISGFYFSDVVSVVSYNNER
VTFRKLMGCHMHEESLFLYQQATGVLGMSLSKPQGIPTFV
NLLFDNAPQLKQVFTICISENGGELIAGGYDPAYIVRAEK
VVWENVTRKYYYYIKVRGLDMFGTNMMSSSKGLEMLVDSG
STFTHIPEDLYNKLNYFFDILCIQDMNNAYDVNKRLKMTN
ESFNNPLVQFDDFRKSLKSIIAKENMCVKIVDGVQCWKYL
EGLPDLFVTLSNNYKMKWQPHSYLYKKESFWCKGIEKQVN
NKPILGLTFFKNRQVIFDIQKNRIGFVDANCPSHP
Description


Functional site

1) chain A
residue 60
type
sequence A
description binding site for residue 4PK A 501
source : AC1

2) chain A
residue 80
type
sequence D
description binding site for residue 4PK A 501
source : AC1

3) chain A
residue 82
type
sequence G
description binding site for residue 4PK A 501
source : AC1

4) chain A
residue 137
type
sequence Q
description binding site for residue 4PK A 501
source : AC1

5) chain A
residue 139
type
sequence Y
description binding site for residue 4PK A 501
source : AC1

6) chain A
residue 140
type
sequence C
description binding site for residue 4PK A 501
source : AC1

7) chain A
residue 141
type
sequence E
description binding site for residue 4PK A 501
source : AC1

8) chain A
residue 179
type
sequence L
description binding site for residue 4PK A 501
source : AC1

9) chain A
residue 180
type
sequence F
description binding site for residue 4PK A 501
source : AC1

10) chain A
residue 183
type
sequence Q
description binding site for residue 4PK A 501
source : AC1

11) chain A
residue 313
type
sequence D
description binding site for residue 4PK A 501
source : AC1

12) chain A
residue 315
type
sequence G
description binding site for residue 4PK A 501
source : AC1

13) chain A
residue 316
type
sequence S
description binding site for residue 4PK A 501
source : AC1

14) chain A
residue 317
type
sequence T
description binding site for residue 4PK A 501
source : AC1

15) chain A
residue 439
type
sequence I
description binding site for residue 4PK A 501
source : AC1

16) chain B
residue 342
type
sequence N
description binding site for residue 4PK A 501
source : AC1

17) chain B
residue 343
type
sequence N
description binding site for residue 4PK A 501
source : AC1

18) chain A
residue 322
type
sequence P
description binding site for residue SO4 A 502
source : AC2

19) chain A
residue 323
type
sequence E
description binding site for residue SO4 A 502
source : AC2

20) chain A
residue 433
type
sequence Q
description binding site for residue SO4 A 502
source : AC2

21) chain A
residue 51
type
sequence K
description binding site for residue SO4 A 503
source : AC3

22) chain A
residue 469
type
sequence H
description binding site for residue SO4 A 503
source : AC3

23) chain A
residue 470
type
sequence P
description binding site for residue SO4 A 503
source : AC3

24) chain A
residue 278
type
sequence W
description binding site for residue SO4 A 504
source : AC4

25) chain A
residue 458
type
sequence R
description binding site for residue SO4 A 504
source : AC4

26) chain A
residue 84
type
sequence S
description binding site for residue EDO A 505
source : AC5

27) chain A
residue 137
type
sequence Q
description binding site for residue EDO A 505
source : AC5

28) chain A
residue 195
type
sequence K
description binding site for residue EDO A 505
source : AC5

29) chain A
residue 286
type
sequence Y
description binding site for residue EDO A 505
source : AC5

30) chain A
residue 338
type
sequence I
description binding site for residue EDO A 506
source : AC6

31) chain A
residue 339
type
sequence Q
description binding site for residue EDO A 506
source : AC6

32) chain A
residue 340
type
sequence D
description binding site for residue EDO A 506
source : AC6

33) chain A
residue 341
type
sequence M
description binding site for residue EDO A 506
source : AC6

34) chain A
residue 381
type
sequence M
description binding site for residue EDO A 506
source : AC6

35) chain A
residue 382
type
sequence C
description binding site for residue EDO A 506
source : AC6

36) chain A
residue 383
type
sequence V
description binding site for residue EDO A 506
source : AC6

37) chain A
residue 84
type
sequence S
description binding site for residue EDO A 507
source : AC7

38) chain A
residue 194
type
sequence S
description binding site for residue EDO A 507
source : AC7

39) chain A
residue 195
type
sequence K
description binding site for residue EDO A 507
source : AC7

40) chain A
residue 198
type
sequence G
description binding site for residue EDO A 507
source : AC7

41) chain A
residue 199
type
sequence I
description binding site for residue EDO A 507
source : AC7

42) chain A
residue 233
type
sequence Y
description binding site for residue EDO A 508
source : AC8

43) chain A
residue 453
type
sequence D
description binding site for residue EDO A 508
source : AC8

44) chain A
residue 458
type
sequence R
description binding site for residue EDO A 508
source : AC8

45) chain A
residue 342
type
sequence N
description binding site for residue 4PK B 501
source : AC9

46) chain A
residue 343
type
sequence N
description binding site for residue 4PK B 501
source : AC9

47) chain B
residue 60
type
sequence A
description binding site for residue 4PK B 501
source : AC9

48) chain B
residue 80
type
sequence D
description binding site for residue 4PK B 501
source : AC9

49) chain B
residue 82
type
sequence G
description binding site for residue 4PK B 501
source : AC9

50) chain B
residue 137
type
sequence Q
description binding site for residue 4PK B 501
source : AC9

51) chain B
residue 139
type
sequence Y
description binding site for residue 4PK B 501
source : AC9

52) chain B
residue 140
type
sequence C
description binding site for residue 4PK B 501
source : AC9

53) chain B
residue 141
type
sequence E
description binding site for residue 4PK B 501
source : AC9

54) chain B
residue 179
type
sequence L
description binding site for residue 4PK B 501
source : AC9

55) chain B
residue 180
type
sequence F
description binding site for residue 4PK B 501
source : AC9

56) chain B
residue 183
type
sequence Q
description binding site for residue 4PK B 501
source : AC9

57) chain B
residue 288
type
sequence Y
description binding site for residue 4PK B 501
source : AC9

58) chain B
residue 313
type
sequence D
description binding site for residue 4PK B 501
source : AC9

59) chain B
residue 315
type
sequence G
description binding site for residue 4PK B 501
source : AC9

60) chain B
residue 316
type
sequence S
description binding site for residue 4PK B 501
source : AC9

61) chain B
residue 317
type
sequence T
description binding site for residue 4PK B 501
source : AC9

62) chain B
residue 320
type
sequence H
description binding site for residue 4PK B 501
source : AC9

63) chain B
residue 439
type
sequence I
description binding site for residue 4PK B 501
source : AC9

64) chain B
residue 83
type
sequence S
description binding site for residue SO4 B 502
source : AD1

65) chain B
residue 84
type
sequence S
description binding site for residue SO4 B 502
source : AD1

66) chain B
residue 137
type
sequence Q
description binding site for residue SO4 B 502
source : AD1

67) chain B
residue 322
type
sequence P
description binding site for residue SO4 B 503
source : AD2

68) chain B
residue 323
type
sequence E
description binding site for residue SO4 B 503
source : AD2

69) chain B
residue 433
type
sequence Q
description binding site for residue SO4 B 503
source : AD2

70) chain B
residue 51
type
sequence K
description binding site for residue SO4 B 504
source : AD3

71) chain B
residue 53
type
sequence Y
description binding site for residue SO4 B 504
source : AD3

72) chain B
residue 469
type
sequence H
description binding site for residue SO4 B 504
source : AD3

73) chain B
residue 470
type
sequence P
description binding site for residue SO4 B 504
source : AD3

74) chain B
residue 278
type
sequence W
description binding site for residue SO4 B 505
source : AD4

75) chain B
residue 458
type
sequence R
description binding site for residue SO4 B 505
source : AD4

76) chain B
residue 84
type
sequence S
description binding site for residue EDO B 506
source : AD5

77) chain B
residue 194
type
sequence S
description binding site for residue EDO B 506
source : AD5

78) chain B
residue 195
type
sequence K
description binding site for residue EDO B 506
source : AD5

79) chain B
residue 198
type
sequence G
description binding site for residue EDO B 506
source : AD5

80) chain B
residue 199
type
sequence I
description binding site for residue EDO B 506
source : AD5

81) chain B
residue 233
type
sequence Y
description binding site for residue EDO B 507
source : AD6

82) chain B
residue 273
type
sequence A
description binding site for residue EDO B 507
source : AD6

83) chain B
residue 274
type
sequence E
description binding site for residue EDO B 507
source : AD6

84) chain B
residue 275
type
sequence K
description binding site for residue EDO B 507
source : AD6

85) chain B
residue 276
type
sequence V
description binding site for residue EDO B 507
source : AD6

86) chain B
residue 117
type
sequence C
description binding site for residue 4PF B 508
source : AD7

87) chain B
residue 117
type
sequence C
description binding site for residue 4PF B 508
source : AD7

88) chain B
residue 118
type
sequence E
description binding site for residue 4PF B 508
source : AD7

89) chain B
residue 120
type
sequence E
description binding site for residue 4PF B 508
source : AD7

90) chain B
residue 121
type
sequence E
description binding site for residue 4PF B 508
source : AD7

91) chain B
residue 121
type
sequence E
description binding site for residue 4PF B 508
source : AD7

92) chain B
residue 122
type
sequence C
description binding site for residue 4PF B 508
source : AD7

93) chain B
residue 122
type
sequence C
description binding site for residue 4PF B 508
source : AD7

94) chain B
residue 126
type
sequence L
description binding site for residue 4PF B 508
source : AD7

95) chain B
residue 128
type
sequence C
description binding site for residue 4PF B 508
source : AD7

96) chain B
residue 128
type
sequence C
description binding site for residue 4PF B 508
source : AD7

97) chain A
residue 310-321
type prosite
sequence MLVDSGSTFTHI
description ASP_PROTEASE Eukaryotic and viral aspartyl proteases active site. LILDTGSSSLSF
source prosite : PS00141

98) chain A
residue 77-88
type prosite
sequence LILDTGSSSLSF
description ASP_PROTEASE Eukaryotic and viral aspartyl proteases active site. LILDTGSSSLSF
source prosite : PS00141

99) chain A
residue 80
type ACT_SITE
sequence D
description ACT_SITE => ECO:0000255|PROSITE-ProRule:PRU01103
source Swiss-Prot : SWS_FT_FI1

100) chain A
residue 313
type ACT_SITE
sequence D
description ACT_SITE => ECO:0000255|PROSITE-ProRule:PRU01103
source Swiss-Prot : SWS_FT_FI1

101) chain B
residue 80
type ACT_SITE
sequence D
description ACT_SITE => ECO:0000255|PROSITE-ProRule:PRU01103
source Swiss-Prot : SWS_FT_FI1

102) chain B
residue 313
type ACT_SITE
sequence D
description ACT_SITE => ECO:0000255|PROSITE-ProRule:PRU01103
source Swiss-Prot : SWS_FT_FI1


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