eF-site ID 1oo6-B
PDB Code 1oo6
Chain B

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Title Nitroreductase from e-coli in complex with the dinitrobenzamide prodrug SN23862
Classification OXIDOREDUCTASE
Compound Oxygen-insensitive NAD(P)H nitroreductase
Source null (NFNB_ECOLI)
Sequence B:  MDIISVALKRHSTKAFDASKKLTPEQAEQIKTLLQYSPSS
TNSQPWHFIVASTEEGKARVAKSAAGNYVFNERKMLDASH
VVVFCAKTAMDDVWLKLVVDQEDADGRFATPEAKAANDKG
RKFFADMHRKDLHDDAEWMAKQVYLNVGNFLLGVAALGLD
AVPIEGFDAAILDAEFGLKEKGYTSLVVVPVGHHSVEDFN
ATLPKSRLPQNITLTEV
Description


Functional site

1) chain B
residue 38
type
sequence P
description BINDING SITE FOR RESIDUE FMN A 218
source : AC1

2) chain B
residue 39
type
sequence S
description BINDING SITE FOR RESIDUE FMN A 218
source : AC1

3) chain B
residue 40
type
sequence S
description BINDING SITE FOR RESIDUE FMN A 218
source : AC1

4) chain B
residue 41
type
sequence T
description BINDING SITE FOR RESIDUE FMN A 218
source : AC1

5) chain B
residue 42
type
sequence N
description BINDING SITE FOR RESIDUE FMN A 218
source : AC1

6) chain B
residue 142
type
sequence Q
description BINDING SITE FOR RESIDUE FMN A 218
source : AC1

7) chain B
residue 145
type
sequence L
description BINDING SITE FOR RESIDUE FMN A 218
source : AC1

8) chain B
residue 14
type
sequence K
description BINDING SITE FOR RESIDUE SN2 A 219
source : AC2

9) chain B
residue 74
type
sequence K
description BINDING SITE FOR RESIDUE SN2 A 219
source : AC2

10) chain B
residue 10
type
sequence R
description BINDING SITE FOR RESIDUE FMN B 220
source : AC3

11) chain B
residue 11
type
sequence H
description BINDING SITE FOR RESIDUE FMN B 220
source : AC3

12) chain B
residue 12
type
sequence S
description BINDING SITE FOR RESIDUE FMN B 220
source : AC3

13) chain B
residue 14
type
sequence K
description BINDING SITE FOR RESIDUE FMN B 220
source : AC3

14) chain B
residue 74
type
sequence K
description BINDING SITE FOR RESIDUE FMN B 220
source : AC3

15) chain B
residue 163
type
sequence P
description BINDING SITE FOR RESIDUE FMN B 220
source : AC3

16) chain B
residue 164
type
sequence I
description BINDING SITE FOR RESIDUE FMN B 220
source : AC3

17) chain B
residue 165
type
sequence E
description BINDING SITE FOR RESIDUE FMN B 220
source : AC3

18) chain B
residue 166
type
sequence G
description BINDING SITE FOR RESIDUE FMN B 220
source : AC3

19) chain B
residue 205
type
sequence K
description BINDING SITE FOR RESIDUE FMN B 220
source : AC3

20) chain B
residue 207
type
sequence R
description BINDING SITE FOR RESIDUE FMN B 220
source : AC3

21) chain B
residue 10
type BINDING
sequence R
description BINDING => ECO:0000269|PubMed:11020276, ECO:0000269|PubMed:11491290, ECO:0000269|PubMed:15684426
source Swiss-Prot : SWS_FT_FI1

22) chain B
residue 165
type BINDING
sequence E
description BINDING => ECO:0000269|PubMed:11020276, ECO:0000269|PubMed:11491290, ECO:0000269|PubMed:15684426
source Swiss-Prot : SWS_FT_FI1

23) chain B
residue 205
type BINDING
sequence K
description BINDING => ECO:0000269|PubMed:11020276, ECO:0000269|PubMed:11491290, ECO:0000269|PubMed:15684426
source Swiss-Prot : SWS_FT_FI1

24) chain B
residue 14
type catalytic
sequence K
description 211
source MCSA : MCSA2

25) chain B
residue 74
type catalytic
sequence K
description 211
source MCSA : MCSA2

26) chain B
residue 165
type catalytic
sequence E
description 211
source MCSA : MCSA2

27) chain B
residue 107
type BINDING
sequence R
description BINDING => ECO:0000250|UniProtKB:Q01234
source Swiss-Prot : SWS_FT_FI2

28) chain B
residue 41
type BINDING
sequence T
description BINDING => ECO:0000250|UniProtKB:Q01234
source Swiss-Prot : SWS_FT_FI2

29) chain B
residue 71
type BINDING
sequence N
description BINDING => ECO:0000250|UniProtKB:Q01234
source Swiss-Prot : SWS_FT_FI2

30) chain B
residue 74
type BINDING
sequence K
description BINDING => ECO:0000250|UniProtKB:Q01234
source Swiss-Prot : SWS_FT_FI2

31) chain B
residue 14
type BINDING
sequence K
description BINDING => ECO:0000250|UniProtKB:Q01234
source Swiss-Prot : SWS_FT_FI2


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