eF-site ID 6dz4-AB
PDB Code 6dz4
Chain A, B

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Title Crystal structure of Salmonella typhimurium Tryptophan Synthase with sodium ion at the metal coordination site and (E)-N-({3-hydroxy-2-methyl-5-[(phosphonooxy)methyl]pyridin-4-yl}methylidene)-L-serine at the beta-site
Classification LYASE/LYASE Inhibitor
Compound Tryptophan synthase alpha chain
Source (TRPB_SALTY)
Sequence A:  MERYENLFAQLNDRREGAFVPFVTLGDPGIEQSLKIIDTL
IDAGADALELGVPFSDPLADGPTIQNANLRAFAAGVTPAQ
CFEMLALIREKHPTIPIGLLMYANLVFNNGIDAFYARCEQ
VGVDSVLVADVPVEESAPFRQAALRHNIAPIFICPPNADD
DLLRQVASYGRGYTYLLSLPLHHLIEKLKEYHAAPALQGF
GISSPEQVSAAVRAGAAGAISGSAIVKIIEKNLASPKQML
AELRSFVSAMKAASR
B:  TTLLNPYFGEFGGMYVPQILMPALNQLEEAFVSAQKDPEF
QAQFADLLKNYAGRPTALTKCQNITAGTRTTLYLKREDLL
HGGAHKTNQVLGQALLAKRMGKSEIIAETGAGQHGVASAL
ASALLGLKCRIYMGAKDVERQSPNVFRMRLMGAEVIPVHS
GSATLKDACNEALRDWSGSYETAHYMLGTAAGPHPYPTIV
REFQRMIGEETKAQILDKEGRLPDAVIACVGGGSNAIGMF
ADFINDTSVGLIGVEPGGHGIETGEHGAPLKHGRVGIYFG
MKAPMMQTADGQIEESYSISAGLDFPSVGPQHAYLNSIGR
ADYVSITDDEALEAFKTLCRHEGIIPALESSHALAHALKM
MREQPEKEQLLVVNLSGRGDKDIFTVHDILKARGE
Description


Functional site

1) chain A
residue 92
type
sequence H
description binding site for residue CL A 301
source : AC1

2) chain A
residue 93
type
sequence P
description binding site for residue CL A 301
source : AC1

3) chain A
residue 94
type
sequence T
description binding site for residue CL A 301
source : AC1

4) chain A
residue 95
type
sequence I
description binding site for residue CL A 301
source : AC1

5) chain A
residue 225
type
sequence R
description binding site for residue CL A 302
source : AC2

6) chain A
residue 82
type
sequence F
description binding site for residue DMS A 303
source : AC3

7) chain A
residue 5
type
sequence E
description binding site for residue DMS A 304
source : AC4

8) chain A
residue 148
type
sequence I
description binding site for residue DMS A 304
source : AC4

9) chain A
residue 149
type
sequence A
description binding site for residue DMS A 304
source : AC4

10) chain A
residue 60
type
sequence D
description binding site for residue DMS A 305
source : AC5

11) chain A
residue 175
type
sequence Y
description binding site for residue DMS A 305
source : AC5

12) chain A
residue 12
type
sequence N
description binding site for residue DMS A 306
source : AC6

13) chain A
residue 16
type
sequence E
description binding site for residue DMS A 306
source : AC6

14) chain B
residue 86
type
sequence H
description binding site for residue KOU B 401
source : AC7

15) chain B
residue 87
type
sequence K
description binding site for residue KOU B 401
source : AC7

16) chain B
residue 110
type
sequence T
description binding site for residue KOU B 401
source : AC7

17) chain B
residue 111
type
sequence G
description binding site for residue KOU B 401
source : AC7

18) chain B
residue 112
type
sequence A
description binding site for residue KOU B 401
source : AC7

19) chain B
residue 113
type
sequence G
description binding site for residue KOU B 401
source : AC7

20) chain B
residue 114
type
sequence Q
description binding site for residue KOU B 401
source : AC7

21) chain B
residue 115
type
sequence H
description binding site for residue KOU B 401
source : AC7

22) chain B
residue 190
type
sequence T
description binding site for residue KOU B 401
source : AC7

23) chain B
residue 232
type
sequence G
description binding site for residue KOU B 401
source : AC7

24) chain B
residue 233
type
sequence G
description binding site for residue KOU B 401
source : AC7

25) chain B
residue 234
type
sequence G
description binding site for residue KOU B 401
source : AC7

26) chain B
residue 235
type
sequence S
description binding site for residue KOU B 401
source : AC7

27) chain B
residue 236
type
sequence N
description binding site for residue KOU B 401
source : AC7

28) chain B
residue 302
type
sequence A
description binding site for residue KOU B 401
source : AC7

29) chain B
residue 303
type
sequence G
description binding site for residue KOU B 401
source : AC7

30) chain B
residue 305
type
sequence D
description binding site for residue KOU B 401
source : AC7

31) chain B
residue 350
type
sequence E
description binding site for residue KOU B 401
source : AC7

32) chain B
residue 377
type
sequence S
description binding site for residue KOU B 401
source : AC7

33) chain B
residue 66
type
sequence T
description binding site for residue NA B 402
source : AC8

34) chain B
residue 69
type
sequence T
description binding site for residue NA B 402
source : AC8

35) chain B
residue 71
type
sequence T
description binding site for residue NA B 402
source : AC8

36) chain B
residue 232
type
sequence G
description binding site for residue NA B 403
source : AC9

37) chain B
residue 306
type
sequence F
description binding site for residue NA B 403
source : AC9

38) chain B
residue 308
type
sequence S
description binding site for residue NA B 403
source : AC9

39) chain B
residue 219
type
sequence K
description binding site for residue CL B 405
source : AD1

40) chain B
residue 220
type
sequence E
description binding site for residue CL B 405
source : AD1

41) chain B
residue 274
type
sequence G
description binding site for residue CL B 406
source : AD2

42) chain A
residue 224
type
sequence V
description binding site for residue CL B 407
source : AD3

43) chain A
residue 225
type
sequence R
description binding site for residue CL B 407
source : AD3

44) chain A
residue 138
type
sequence P
description binding site for residue CL B 409
source : AD4

45) chain B
residue 283
type
sequence K
description binding site for residue CL B 409
source : AD4

46) chain B
residue 42
type
sequence Q
description binding site for residue DMS B 410
source : AD5

47) chain B
residue 46
type
sequence A
description binding site for residue DMS B 410
source : AD5

48) chain B
residue 271
type
sequence L
description binding site for residue DMS B 411
source : AD6

49) chain B
residue 317
type
sequence N
description binding site for residue DMS B 411
source : AD6

50) chain B
residue 363
type
sequence R
description binding site for residue DMS B 411
source : AD6

51) chain B
residue 364
type
sequence E
description binding site for residue DMS B 411
source : AD6

52) chain B
residue 143
type
sequence S
description binding site for residue DMS B 412
source : AD7

53) chain B
residue 144
type
sequence P
description binding site for residue DMS B 412
source : AD7

54) chain B
residue 385
type
sequence F
description binding site for residue DMS B 412
source : AD7

55) chain B
residue 388
type
sequence H
description binding site for residue DMS B 412
source : AD7

56) chain B
residue 262
type
sequence I
description binding site for residue DMS B 413
source : AD8

57) chain B
residue 267
type
sequence H
description binding site for residue DMS B 413
source : AD8

58) chain B
residue 273
type
sequence H
description binding site for residue DMS B 413
source : AD8

59) chain B
residue 36
type
sequence Q
description binding site for residue DMS B 414
source : AD9

60) chain B
residue 37
type
sequence K
description binding site for residue DMS B 414
source : AD9

61) chain B
residue 8
type
sequence Y
description binding site for residue DMS B 415
source : AE1

62) chain B
residue 10
type
sequence G
description binding site for residue DMS B 415
source : AE1

63) chain B
residue 3
type
sequence T
description binding site for residue DMS B 416
source : AE2

64) chain B
residue 4
type
sequence L
description binding site for residue DMS B 416
source : AE2

65) chain B
residue 5
type
sequence L
description binding site for residue DMS B 416
source : AE2

66) chain B
residue 6
type
sequence N
description binding site for residue DMS B 416
source : AE2

67) chain B
residue 357
type
sequence H
description binding site for residue DMS B 417
source : AE3

68) chain B
residue 364
type
sequence E
description binding site for residue DMS B 417
source : AE3

69) chain B
residue 87
type MOD_RES
sequence K
description N6-(pyridoxal phosphate)lysine
source Swiss-Prot : SWS_FT_FI1

70) chain A
residue 60
type MOD_RES
sequence D
description N6-(pyridoxal phosphate)lysine
source Swiss-Prot : SWS_FT_FI1

71) chain B
residue 87
type catalytic
sequence K
description 383
source MCSA : MCSA1

72) chain B
residue 109
type catalytic
sequence E
description 383
source MCSA : MCSA1

73) chain B
residue 377
type catalytic
sequence S
description 383
source MCSA : MCSA1

74) chain A
residue 48-61
type prosite
sequence LELGVPFSDPLADG
description TRP_SYNTHASE_ALPHA Tryptophan synthase alpha chain signature. LELGvPFSDPLADG
source prosite : PS00167

75) chain B
residue 80-94
type prosite
sequence LLHGGAHKTNQVLGQ
description TRP_SYNTHASE_BETA Tryptophan synthase beta chain pyridoxal-phosphate attachment site. LlHgGAHKtNqvLgQ
source prosite : PS00168


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