eF-site ID 1oon-AB
PDB Code 1oon
Chain A, B

click to enlarge
Title Nitroreductase from e-coli in complex with the dinitrobenzamide prodrug SN27217
Classification OXIDOREDUCTASE
Compound Oxygen-insensitive NAD(P)H nitroreductase
Source null (NFNB_ECOLI)
Sequence A:  DIISVALKRHSTKAFDASKKLTPEQAEQIKTLLQYSPSST
NSQPWHFIVASTEEGKARVAKSAAGNYVFNERKMLDASHV
VVFCAKTAMDDVWLKLVVDQEDADGRFATPEAKAANDKGR
KFFADMHRKDLHDDAEWMAKQVYLNVGNFLLGVAALGLDA
VPIEGFDAAILDAEFGLKEKGYTSLVVVPVGHHSVEDFNA
TLPKSRLPQNITLTEV
B:  DIISVALKRHSTKAFDASKKLTPEQAEQIKTLLQYSPSST
NSQPWHFIVASTEEGKARVAKSAAGNYVFNERKMLDASHV
VVFCAKTAMDDVWLKLVVDQEDADGRFATPEAKAANDKGR
KFFADMHRKDLHDDAEWMAKQVYLNVGNFLLGVAALGLDA
VPIEGFDAAILDAEFGLKEKGYTSLVVVPVGHHSVEDFNA
TLPKSRLPQNITLTEV
Description


Functional site
1) chain A
residue 10
type
sequence R
description BINDING SITE FOR RESIDUE FMN A 360
source : AC1
2) chain A
residue 11
type
sequence H
description BINDING SITE FOR RESIDUE FMN A 360
source : AC1
3) chain A
residue 12
type
sequence S
description BINDING SITE FOR RESIDUE FMN A 360
source : AC1
4) chain A
residue 14
type
sequence K
description BINDING SITE FOR RESIDUE FMN A 360
source : AC1
5) chain A
residue 71
type
sequence N
description BINDING SITE FOR RESIDUE FMN A 360
source : AC1
6) chain A
residue 74
type
sequence K
description BINDING SITE FOR RESIDUE FMN A 360
source : AC1
7) chain A
residue 144
type
sequence Y
description BINDING SITE FOR RESIDUE FMN A 360
source : AC1
8) chain A
residue 163
type
sequence P
description BINDING SITE FOR RESIDUE FMN A 360
source : AC1
9) chain A
residue 164
type
sequence I
description BINDING SITE FOR RESIDUE FMN A 360
source : AC1
10) chain A
residue 165
type
sequence E
description BINDING SITE FOR RESIDUE FMN A 360
source : AC1
11) chain A
residue 166
type
sequence G
description BINDING SITE FOR RESIDUE FMN A 360
source : AC1
12) chain A
residue 200
type
sequence N
description BINDING SITE FOR RESIDUE FMN A 360
source : AC1
13) chain A
residue 205
type
sequence K
description BINDING SITE FOR RESIDUE FMN A 360
source : AC1
14) chain A
residue 207
type
sequence R
description BINDING SITE FOR RESIDUE FMN A 360
source : AC1
15) chain B
residue 38
type
sequence P
description BINDING SITE FOR RESIDUE FMN A 360
source : AC1
16) chain B
residue 39
type
sequence S
description BINDING SITE FOR RESIDUE FMN A 360
source : AC1
17) chain B
residue 40
type
sequence S
description BINDING SITE FOR RESIDUE FMN A 360
source : AC1
18) chain B
residue 41
type
sequence T
description BINDING SITE FOR RESIDUE FMN A 360
source : AC1
19) chain B
residue 42
type
sequence N
description BINDING SITE FOR RESIDUE FMN A 360
source : AC1
20) chain B
residue 142
type
sequence Q
description BINDING SITE FOR RESIDUE FMN A 360
source : AC1
21) chain B
residue 145
type
sequence L
description BINDING SITE FOR RESIDUE FMN A 360
source : AC1
22) chain A
residue 38
type
sequence P
description BINDING SITE FOR RESIDUE FMN B 361
source : AC2
23) chain A
residue 39
type
sequence S
description BINDING SITE FOR RESIDUE FMN B 361
source : AC2
24) chain A
residue 40
type
sequence S
description BINDING SITE FOR RESIDUE FMN B 361
source : AC2
25) chain A
residue 42
type
sequence N
description BINDING SITE FOR RESIDUE FMN B 361
source : AC2
26) chain A
residue 142
type
sequence Q
description BINDING SITE FOR RESIDUE FMN B 361
source : AC2
27) chain A
residue 145
type
sequence L
description BINDING SITE FOR RESIDUE FMN B 361
source : AC2
28) chain B
residue 10
type
sequence R
description BINDING SITE FOR RESIDUE FMN B 361
source : AC2
29) chain B
residue 11
type
sequence H
description BINDING SITE FOR RESIDUE FMN B 361
source : AC2
30) chain B
residue 12
type
sequence S
description BINDING SITE FOR RESIDUE FMN B 361
source : AC2
31) chain B
residue 14
type
sequence K
description BINDING SITE FOR RESIDUE FMN B 361
source : AC2
32) chain B
residue 71
type
sequence N
description BINDING SITE FOR RESIDUE FMN B 361
source : AC2
33) chain B
residue 74
type
sequence K
description BINDING SITE FOR RESIDUE FMN B 361
source : AC2
34) chain B
residue 144
type
sequence Y
description BINDING SITE FOR RESIDUE FMN B 361
source : AC2
35) chain B
residue 163
type
sequence P
description BINDING SITE FOR RESIDUE FMN B 361
source : AC2
36) chain B
residue 165
type
sequence E
description BINDING SITE FOR RESIDUE FMN B 361
source : AC2
37) chain B
residue 166
type
sequence G
description BINDING SITE FOR RESIDUE FMN B 361
source : AC2
38) chain B
residue 205
type
sequence K
description BINDING SITE FOR RESIDUE FMN B 361
source : AC2
39) chain B
residue 207
type
sequence R
description BINDING SITE FOR RESIDUE FMN B 361
source : AC2
40) chain A
residue 41
type
sequence T
description BINDING SITE FOR RESIDUE BEL A 362
source : AC3
41) chain A
residue 102
type
sequence E
description BINDING SITE FOR RESIDUE BEL A 362
source : AC3
42) chain A
residue 107
type
sequence R
description BINDING SITE FOR RESIDUE BEL A 362
source : AC3
43) chain A
residue 117
type
sequence N
description BINDING SITE FOR RESIDUE BEL A 362
source : AC3
44) chain A
residue 124
type
sequence F
description BINDING SITE FOR RESIDUE BEL A 362
source : AC3
45) chain B
residue 14
type
sequence K
description BINDING SITE FOR RESIDUE BEL A 362
source : AC3
46) chain B
residue 70
type
sequence F
description BINDING SITE FOR RESIDUE BEL A 362
source : AC3
47) chain A
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
48) chain A
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
49) chain A
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
50) 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
51) 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
52) 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
53) chain A
residue 14
type catalytic
sequence K
description 211
source MCSA : MCSA1
54) chain A
residue 74
type catalytic
sequence K
description 211
source MCSA : MCSA1
55) chain A
residue 165
type catalytic
sequence E
description 211
source MCSA : MCSA1
56) chain B
residue 14
type catalytic
sequence K
description 211
source MCSA : MCSA2
57) chain B
residue 74
type catalytic
sequence K
description 211
source MCSA : MCSA2
58) chain B
residue 165
type catalytic
sequence E
description 211
source MCSA : MCSA2
59) chain A
residue 71
type BINDING
sequence N
description BINDING => ECO:0000250|UniProtKB:Q01234
source Swiss-Prot : SWS_FT_FI2
60) chain A
residue 74
type BINDING
sequence K
description BINDING => ECO:0000250|UniProtKB:Q01234
source Swiss-Prot : SWS_FT_FI2
61) chain A
residue 107
type BINDING
sequence R
description BINDING => ECO:0000250|UniProtKB:Q01234
source Swiss-Prot : SWS_FT_FI2
62) chain B
residue 14
type BINDING
sequence K
description BINDING => ECO:0000250|UniProtKB:Q01234
source Swiss-Prot : SWS_FT_FI2
63) chain A
residue 14
type BINDING
sequence K
description BINDING => ECO:0000250|UniProtKB:Q01234
source Swiss-Prot : SWS_FT_FI2
64) chain A
residue 41
type BINDING
sequence T
description BINDING => ECO:0000250|UniProtKB:Q01234
source Swiss-Prot : SWS_FT_FI2
65) chain B
residue 107
type BINDING
sequence R
description BINDING => ECO:0000250|UniProtKB:Q01234
source Swiss-Prot : SWS_FT_FI2
66) chain B
residue 41
type BINDING
sequence T
description BINDING => ECO:0000250|UniProtKB:Q01234
source Swiss-Prot : SWS_FT_FI2
67) chain B
residue 71
type BINDING
sequence N
description BINDING => ECO:0000250|UniProtKB:Q01234
source Swiss-Prot : SWS_FT_FI2
68) chain B
residue 74
type BINDING
sequence K
description BINDING => ECO:0000250|UniProtKB:Q01234
source Swiss-Prot : SWS_FT_FI2

Display surface

Download
Links