eF-site ID 4y6g-AB
PDB Code 4y6g
Chain A, B

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Title Crystal structure of Tryptophan Synthase from Salmonella typhimurium in complex with N-(4'-trifluoromethoxybenzoyl)-2-amino-1-ethylphosphate (F6F) inhibitor in the alpha-site and beta-site.
Classification LYASE/LYASE INHIBITOR
Compound Tryptophan synthase alpha chain
Source (TRPB_SALTY)
Sequence A:  MERYENLFAQLNDRREGAFVPFVTLGDPGIEQSLKIIDTL
IDAGADALELGVPFSDPLADGPTIQNANLRAFAAGVTPAQ
CFEMLALIREKHPTIPIGLLMYANLVFNNGIDAFYARCEQ
VGVDSVLVADVPVEESAPFRQAALRHNIAPIFICPPNADD
DLLRQVASYGRGYTYLLSRSGLHHLIEKLKEYHAAPALQG
FGISSPEQVSAAVRAGAAGAISGSAIVKIIEKNLASPKQM
LAELRSFVSAMKAASRA
B:  TTLLNPYFGEFGGMYVPQILMPALNQLEEAFVSAQKDPEF
QAQFADLLKNYAGRPTALTKCQNITAGTRTTLYLKREDLL
HGGAHKTNQVLGQALLAKRMGKSEIIAETGAGQHGVASAL
ASALLGLKCRIYMGAKDVERQSPNVFRMRLMGAEVIPVHS
GSATLKDACNEALRDWSGSYETAHYMLGTAAGPHPYPTIV
REFQRMIGEETKAQILDKEGRLPDAVIACVGGGSNAIGMF
ADFINDTSVGLIGVEPGGHGIETGEHGAPLKHGRVGIYFG
MKAPMMQTADGQIEESYSISAGLDFPSVGPQHAYLNSIGR
ADYVSITDDEALEAFKTLCRHEGIIPALESSHALAHALKM
MREQPEKEQLLVVNLSGRGDKDIFTVHDILKARGEI
Description


Functional site

1) chain A
residue 49
type
sequence E
description binding site for residue F6F A 301
source : AC1

2) chain A
residue 59
type
sequence A
description binding site for residue F6F A 301
source : AC1

3) chain A
residue 60
type
sequence D
description binding site for residue F6F A 301
source : AC1

4) chain A
residue 64
type
sequence I
description binding site for residue F6F A 301
source : AC1

5) chain A
residue 100
type
sequence L
description binding site for residue F6F A 301
source : AC1

6) chain A
residue 127
type
sequence L
description binding site for residue F6F A 301
source : AC1

7) chain A
residue 129
type
sequence A
description binding site for residue F6F A 301
source : AC1

8) chain A
residue 153
type
sequence I
description binding site for residue F6F A 301
source : AC1

9) chain A
residue 175
type
sequence Y
description binding site for residue F6F A 301
source : AC1

10) chain A
residue 212
type
sequence F
description binding site for residue F6F A 301
source : AC1

11) chain A
residue 213
type
sequence G
description binding site for residue F6F A 301
source : AC1

12) chain A
residue 234
type
sequence G
description binding site for residue F6F A 301
source : AC1

13) chain A
residue 235
type
sequence S
description binding site for residue F6F A 301
source : AC1

14) chain B
residue 18
type
sequence P
description binding site for residue F6F A 301
source : AC1

15) chain B
residue 86
type
sequence H
description binding site for residue PLP B 401
source : AC2

16) chain B
residue 87
type
sequence K
description binding site for residue PLP B 401
source : AC2

17) chain B
residue 114
type
sequence Q
description binding site for residue PLP B 401
source : AC2

18) chain B
residue 190
type
sequence T
description binding site for residue PLP B 401
source : AC2

19) chain B
residue 230
type
sequence C
description binding site for residue PLP B 401
source : AC2

20) chain B
residue 232
type
sequence G
description binding site for residue PLP B 401
source : AC2

21) chain B
residue 233
type
sequence G
description binding site for residue PLP B 401
source : AC2

22) chain B
residue 234
type
sequence G
description binding site for residue PLP B 401
source : AC2

23) chain B
residue 235
type
sequence S
description binding site for residue PLP B 401
source : AC2

24) chain B
residue 236
type
sequence N
description binding site for residue PLP B 401
source : AC2

25) chain B
residue 303
type
sequence G
description binding site for residue PLP B 401
source : AC2

26) chain B
residue 350
type
sequence E
description binding site for residue PLP B 401
source : AC2

27) chain B
residue 377
type
sequence S
description binding site for residue PLP B 401
source : AC2

28) chain B
residue 378
type
sequence G
description binding site for residue PLP B 401
source : AC2

29) chain B
residue 87
type
sequence K
description binding site for residue F6F B 402
source : AC3

30) chain B
residue 109
type
sequence E
description binding site for residue F6F B 402
source : AC3

31) chain B
residue 110
type
sequence T
description binding site for residue F6F B 402
source : AC3

32) chain B
residue 111
type
sequence G
description binding site for residue F6F B 402
source : AC3

33) chain B
residue 112
type
sequence A
description binding site for residue F6F B 402
source : AC3

34) chain B
residue 113
type
sequence G
description binding site for residue F6F B 402
source : AC3

35) chain B
residue 114
type
sequence Q
description binding site for residue F6F B 402
source : AC3

36) chain B
residue 115
type
sequence H
description binding site for residue F6F B 402
source : AC3

37) chain B
residue 170
type
sequence C
description binding site for residue F6F B 402
source : AC3

38) chain B
residue 174
type
sequence L
description binding site for residue F6F B 402
source : AC3

39) chain B
residue 186
type
sequence Y
description binding site for residue F6F B 402
source : AC3

40) chain B
residue 188
type
sequence L
description binding site for residue F6F B 402
source : AC3

41) chain B
residue 190
type
sequence T
description binding site for residue F6F B 402
source : AC3

42) chain B
residue 193
type
sequence G
description binding site for residue F6F B 402
source : AC3

43) chain B
residue 280
type
sequence F
description binding site for residue F6F B 402
source : AC3

44) chain B
residue 306
type
sequence F
description binding site for residue F6F B 402
source : AC3

45) chain B
residue 232
type
sequence G
description binding site for residue NA B 403
source : AC4

46) chain B
residue 306
type
sequence F
description binding site for residue NA B 403
source : AC4

47) chain B
residue 308
type
sequence S
description binding site for residue NA B 403
source : AC4

48) 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

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

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

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

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

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

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


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