eF-site ID 3ke8-AB
PDB Code 3ke8
Chain A, B

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Title Crystal structure of IspH:HMBPP-complex
Classification OXIDOREDUCTASE
Compound 4-hydroxy-3-methylbut-2-enyl diphosphate reductase
Source Escherichia coli (strain K12) (ISPH_ECOLI)
Sequence A:  MQILLANPRGFCAGVDRAISIVENALAIYGAPIYVRHEVV
HNRYVVDSLRERGAIFIEQISEVPDGAILIFSAHGVSQAV
RNEAKSRDLTVFDATCPLVTKVHMEVARASRRGEESILIG
HAGHPEVEGTMGQYSNPEGGMYLVESPDDVWKLTVKNEEK
LSFMTQTTLSVDDTSDVIDALRKRFPKIVGPRKDDICYAT
TNRQEAVRALAEQAEVVLVVGSKNSSNSNRLAELAQRMGK
RAFLIDDAKDIQEEWVKEVKCVGVTAGASAPDILVQNVVA
RLQQLGGGEAIPLEGREENIVFEVPKELR
B:  MQILLANPRGFCAGVDRAISIVENALAIYGAPIYVRHEVV
HNRYVVDSLRERGAIFIEQISEVPDGAILIFSAHGVSQAV
RNEAKSRDLTVFDATCPLVTKVHMEVARASRRGEESILIG
HAGHPEVEGTMGQYSNPEGGMYLVESPDDVWKLTVKNEEK
LSFMTQTTLSVDDTSDVIDALRKRFPKIVGPRKDDICYAT
TNRQEAVRALAEQAEVVLVVGSKNSSNSNRLAELAQRMGK
RAFLIDDAKDIQEEWVKEVKCVGVTAGASAPDILVQNVVA
RLQQLGGGEAIPLEGREENIVFEVPKELRV
Description


Functional site
1) chain A
residue 12
type
sequence C
description BINDING SITE FOR RESIDUE SF4 A 997
source : AC1
2) chain A
residue 14
type
sequence G
description BINDING SITE FOR RESIDUE SF4 A 997
source : AC1
3) chain A
residue 96
type
sequence C
description BINDING SITE FOR RESIDUE SF4 A 997
source : AC1
4) chain A
residue 98
type
sequence L
description BINDING SITE FOR RESIDUE SF4 A 997
source : AC1
5) chain A
residue 197
type
sequence C
description BINDING SITE FOR RESIDUE SF4 A 997
source : AC1
6) chain A
residue 15
type
sequence V
description BINDING SITE FOR RESIDUE EIP A 998
source : AC2
7) chain A
residue 40
type
sequence V
description BINDING SITE FOR RESIDUE EIP A 998
source : AC2
8) chain A
residue 41
type
sequence H
description BINDING SITE FOR RESIDUE EIP A 998
source : AC2
9) chain A
residue 73
type
sequence A
description BINDING SITE FOR RESIDUE EIP A 998
source : AC2
10) chain A
residue 74
type
sequence H
description BINDING SITE FOR RESIDUE EIP A 998
source : AC2
11) chain A
residue 99
type
sequence V
description BINDING SITE FOR RESIDUE EIP A 998
source : AC2
12) chain A
residue 124
type
sequence H
description BINDING SITE FOR RESIDUE EIP A 998
source : AC2
13) chain A
residue 126
type
sequence E
description BINDING SITE FOR RESIDUE EIP A 998
source : AC2
14) chain A
residue 167
type
sequence T
description BINDING SITE FOR RESIDUE EIP A 998
source : AC2
15) chain A
residue 168
type
sequence T
description BINDING SITE FOR RESIDUE EIP A 998
source : AC2
16) chain A
residue 224
type
sequence N
description BINDING SITE FOR RESIDUE EIP A 998
source : AC2
17) chain A
residue 225
type
sequence S
description BINDING SITE FOR RESIDUE EIP A 998
source : AC2
18) chain A
residue 226
type
sequence S
description BINDING SITE FOR RESIDUE EIP A 998
source : AC2
19) chain A
residue 227
type
sequence N
description BINDING SITE FOR RESIDUE EIP A 998
source : AC2
20) chain A
residue 269
type
sequence S
description BINDING SITE FOR RESIDUE EIP A 998
source : AC2
21) chain B
residue 12
type
sequence C
description BINDING SITE FOR RESIDUE SF4 B 997
source : AC3
22) chain B
residue 14
type
sequence G
description BINDING SITE FOR RESIDUE SF4 B 997
source : AC3
23) chain B
residue 96
type
sequence C
description BINDING SITE FOR RESIDUE SF4 B 997
source : AC3
24) chain B
residue 98
type
sequence L
description BINDING SITE FOR RESIDUE SF4 B 997
source : AC3
25) chain B
residue 197
type
sequence C
description BINDING SITE FOR RESIDUE SF4 B 997
source : AC3
26) chain B
residue 15
type
sequence V
description BINDING SITE FOR RESIDUE EIP B 998
source : AC4
27) chain B
residue 40
type
sequence V
description BINDING SITE FOR RESIDUE EIP B 998
source : AC4
28) chain B
residue 41
type
sequence H
description BINDING SITE FOR RESIDUE EIP B 998
source : AC4
29) chain B
residue 73
type
sequence A
description BINDING SITE FOR RESIDUE EIP B 998
source : AC4
30) chain B
residue 74
type
sequence H
description BINDING SITE FOR RESIDUE EIP B 998
source : AC4
31) chain B
residue 99
type
sequence V
description BINDING SITE FOR RESIDUE EIP B 998
source : AC4
32) chain B
residue 124
type
sequence H
description BINDING SITE FOR RESIDUE EIP B 998
source : AC4
33) chain B
residue 126
type
sequence E
description BINDING SITE FOR RESIDUE EIP B 998
source : AC4
34) chain B
residue 167
type
sequence T
description BINDING SITE FOR RESIDUE EIP B 998
source : AC4
35) chain B
residue 168
type
sequence T
description BINDING SITE FOR RESIDUE EIP B 998
source : AC4
36) chain B
residue 224
type
sequence N
description BINDING SITE FOR RESIDUE EIP B 998
source : AC4
37) chain B
residue 225
type
sequence S
description BINDING SITE FOR RESIDUE EIP B 998
source : AC4
38) chain B
residue 226
type
sequence S
description BINDING SITE FOR RESIDUE EIP B 998
source : AC4
39) chain B
residue 227
type
sequence N
description BINDING SITE FOR RESIDUE EIP B 998
source : AC4
40) chain B
residue 269
type
sequence S
description BINDING SITE FOR RESIDUE EIP B 998
source : AC4
41) chain A
residue 126
type ACT_SITE
sequence E
description Proton donor => ECO:0000305|PubMed:22137895, ECO:0000305|PubMed:22687151
source Swiss-Prot : SWS_FT_FI1
42) chain B
residue 126
type ACT_SITE
sequence E
description Proton donor => ECO:0000305|PubMed:22137895, ECO:0000305|PubMed:22687151
source Swiss-Prot : SWS_FT_FI1
43) chain A
residue 12
type BINDING
sequence C
description BINDING => ECO:0000269|PubMed:20080550, ECO:0000269|PubMed:22137895, ECO:0000269|PubMed:22687151, ECO:0000269|PubMed:22948824, ECO:0000269|PubMed:23307751, ECO:0007744|PDB:3KE8, ECO:0007744|PDB:3SZL, ECO:0007744|PDB:3URK, ECO:0007744|PDB:4EB3, ECO:0007744|PDB:4H4C
source Swiss-Prot : SWS_FT_FI2
44) chain A
residue 96
type BINDING
sequence C
description BINDING => ECO:0000269|PubMed:20080550, ECO:0000269|PubMed:22137895, ECO:0000269|PubMed:22687151, ECO:0000269|PubMed:22948824, ECO:0000269|PubMed:23307751, ECO:0007744|PDB:3KE8, ECO:0007744|PDB:3SZL, ECO:0007744|PDB:3URK, ECO:0007744|PDB:4EB3, ECO:0007744|PDB:4H4C
source Swiss-Prot : SWS_FT_FI2
45) chain A
residue 197
type BINDING
sequence C
description BINDING => ECO:0000269|PubMed:20080550, ECO:0000269|PubMed:22137895, ECO:0000269|PubMed:22687151, ECO:0000269|PubMed:22948824, ECO:0000269|PubMed:23307751, ECO:0007744|PDB:3KE8, ECO:0007744|PDB:3SZL, ECO:0007744|PDB:3URK, ECO:0007744|PDB:4EB3, ECO:0007744|PDB:4H4C
source Swiss-Prot : SWS_FT_FI2
46) chain B
residue 12
type BINDING
sequence C
description BINDING => ECO:0000269|PubMed:20080550, ECO:0000269|PubMed:22137895, ECO:0000269|PubMed:22687151, ECO:0000269|PubMed:22948824, ECO:0000269|PubMed:23307751, ECO:0007744|PDB:3KE8, ECO:0007744|PDB:3SZL, ECO:0007744|PDB:3URK, ECO:0007744|PDB:4EB3, ECO:0007744|PDB:4H4C
source Swiss-Prot : SWS_FT_FI2
47) chain B
residue 96
type BINDING
sequence C
description BINDING => ECO:0000269|PubMed:20080550, ECO:0000269|PubMed:22137895, ECO:0000269|PubMed:22687151, ECO:0000269|PubMed:22948824, ECO:0000269|PubMed:23307751, ECO:0007744|PDB:3KE8, ECO:0007744|PDB:3SZL, ECO:0007744|PDB:3URK, ECO:0007744|PDB:4EB3, ECO:0007744|PDB:4H4C
source Swiss-Prot : SWS_FT_FI2
48) chain B
residue 197
type BINDING
sequence C
description BINDING => ECO:0000269|PubMed:20080550, ECO:0000269|PubMed:22137895, ECO:0000269|PubMed:22687151, ECO:0000269|PubMed:22948824, ECO:0000269|PubMed:23307751, ECO:0007744|PDB:3KE8, ECO:0007744|PDB:3SZL, ECO:0007744|PDB:3URK, ECO:0007744|PDB:4EB3, ECO:0007744|PDB:4H4C
source Swiss-Prot : SWS_FT_FI2
49) chain A
residue 41
type BINDING
sequence H
description BINDING => ECO:0000269|PubMed:20080550, ECO:0000269|PubMed:22137895, ECO:0000305|PubMed:22687151, ECO:0007744|PDB:3KE8, ECO:0007744|PDB:3SZL, ECO:0007744|PDB:4EB3
source Swiss-Prot : SWS_FT_FI3
50) chain B
residue 167
type BINDING
sequence T
description BINDING => ECO:0000269|PubMed:20080550, ECO:0000269|PubMed:22137895, ECO:0000305|PubMed:22687151, ECO:0007744|PDB:3KE8, ECO:0007744|PDB:3SZL, ECO:0007744|PDB:4EB3
source Swiss-Prot : SWS_FT_FI3
51) chain B
residue 225
type BINDING
sequence S
description BINDING => ECO:0000269|PubMed:20080550, ECO:0000269|PubMed:22137895, ECO:0000305|PubMed:22687151, ECO:0007744|PDB:3KE8, ECO:0007744|PDB:3SZL, ECO:0007744|PDB:4EB3
source Swiss-Prot : SWS_FT_FI3
52) chain B
residue 269
type BINDING
sequence S
description BINDING => ECO:0000269|PubMed:20080550, ECO:0000269|PubMed:22137895, ECO:0000305|PubMed:22687151, ECO:0007744|PDB:3KE8, ECO:0007744|PDB:3SZL, ECO:0007744|PDB:4EB3
source Swiss-Prot : SWS_FT_FI3
53) chain A
residue 74
type BINDING
sequence H
description BINDING => ECO:0000269|PubMed:20080550, ECO:0000269|PubMed:22137895, ECO:0000305|PubMed:22687151, ECO:0007744|PDB:3KE8, ECO:0007744|PDB:3SZL, ECO:0007744|PDB:4EB3
source Swiss-Prot : SWS_FT_FI3
54) chain A
residue 124
type BINDING
sequence H
description BINDING => ECO:0000269|PubMed:20080550, ECO:0000269|PubMed:22137895, ECO:0000305|PubMed:22687151, ECO:0007744|PDB:3KE8, ECO:0007744|PDB:3SZL, ECO:0007744|PDB:4EB3
source Swiss-Prot : SWS_FT_FI3
55) chain A
residue 167
type BINDING
sequence T
description BINDING => ECO:0000269|PubMed:20080550, ECO:0000269|PubMed:22137895, ECO:0000305|PubMed:22687151, ECO:0007744|PDB:3KE8, ECO:0007744|PDB:3SZL, ECO:0007744|PDB:4EB3
source Swiss-Prot : SWS_FT_FI3
56) chain A
residue 225
type BINDING
sequence S
description BINDING => ECO:0000269|PubMed:20080550, ECO:0000269|PubMed:22137895, ECO:0000305|PubMed:22687151, ECO:0007744|PDB:3KE8, ECO:0007744|PDB:3SZL, ECO:0007744|PDB:4EB3
source Swiss-Prot : SWS_FT_FI3
57) chain A
residue 269
type BINDING
sequence S
description BINDING => ECO:0000269|PubMed:20080550, ECO:0000269|PubMed:22137895, ECO:0000305|PubMed:22687151, ECO:0007744|PDB:3KE8, ECO:0007744|PDB:3SZL, ECO:0007744|PDB:4EB3
source Swiss-Prot : SWS_FT_FI3
58) chain B
residue 41
type BINDING
sequence H
description BINDING => ECO:0000269|PubMed:20080550, ECO:0000269|PubMed:22137895, ECO:0000305|PubMed:22687151, ECO:0007744|PDB:3KE8, ECO:0007744|PDB:3SZL, ECO:0007744|PDB:4EB3
source Swiss-Prot : SWS_FT_FI3
59) chain B
residue 74
type BINDING
sequence H
description BINDING => ECO:0000269|PubMed:20080550, ECO:0000269|PubMed:22137895, ECO:0000305|PubMed:22687151, ECO:0007744|PDB:3KE8, ECO:0007744|PDB:3SZL, ECO:0007744|PDB:4EB3
source Swiss-Prot : SWS_FT_FI3
60) chain B
residue 124
type BINDING
sequence H
description BINDING => ECO:0000269|PubMed:20080550, ECO:0000269|PubMed:22137895, ECO:0000305|PubMed:22687151, ECO:0007744|PDB:3KE8, ECO:0007744|PDB:3SZL, ECO:0007744|PDB:4EB3
source Swiss-Prot : SWS_FT_FI3

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