eF-site ID 6o52-A
PDB Code 6o52
Chain A

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Title Room temperature structure of binary complex of native hAChE with BW284c51
Classification HYDROLASE
Compound Acetylcholinesterase
Source (ACES_HUMAN)
Sequence A:  EDAELLVTVRGGRLRGIRLKTPGGPVSAFLGIPFAEPPMG
PRRFLPPEPKQPWSGVVDATTFQSVCYQYVDTLYPGFEGT
EMWNPNRELSEDCLYLNVWTPYPRPTSPTPVLVWIYGGGF
YSGASSLDVYDGRFLVQAERTVLVSMNYRVGAFGFLALPG
SREAPGNVGLLDQRLALQWVQENVAAFGGDPTSVTLFGES
AGAASVGMHLLSPPSRGLFHRAVLQSGAPNGPWATVGMGE
ARRRATQLAHLVGCPPGGTGGNDTELVACLRTRPAQVLVN
HEWHVLPQESVFRFSFVPVVDGDFLSDTPEALINAGDFHG
LQVLVGVVKDEGSYFLVYGAPGFSKDNESLISRAEFLAGV
RVGVPQVSDLAAEAVVLHYTDWLHPEDPARLREALSDVVG
DHNVVCPVAQLAGRLAAQGARVYAYVFEHRASTLSWPLWM
GVPHGYEIEFIFGIPLDPSRNYTAEEKIFAQRLMRYWANF
ARTGDPNEPRDPKAPQWPPYTAGAQQYVSLDLRPLEVRRG
LRAQACAFWNRFLPKLLSAT
Description


Functional site

1) chain A
residue 86
type
sequence W
description binding site for residue EBW A 601
source : AC1

2) chain A
residue 124
type
sequence Y
description binding site for residue EBW A 601
source : AC1

3) chain A
residue 202
type
sequence E
description binding site for residue EBW A 601
source : AC1

4) chain A
residue 203
type
sequence S
description binding site for residue EBW A 601
source : AC1

5) chain A
residue 286
type
sequence W
description binding site for residue EBW A 601
source : AC1

6) chain A
residue 297
type
sequence F
description binding site for residue EBW A 601
source : AC1

7) chain A
residue 337
type
sequence Y
description binding site for residue EBW A 601
source : AC1

8) chain A
residue 338
type
sequence F
description binding site for residue EBW A 601
source : AC1

9) chain A
residue 341
type
sequence Y
description binding site for residue EBW A 601
source : AC1

10) chain A
residue 447
type
sequence H
description binding site for residue EBW A 601
source : AC1

11) chain A
residue 203
type ACT_SITE
sequence S
description Acyl-ester intermediate
source Swiss-Prot : SWS_FT_FI1

12) chain A
residue 334
type ACT_SITE
sequence E
description Charge relay system
source Swiss-Prot : SWS_FT_FI2

13) chain A
residue 447
type ACT_SITE
sequence H
description Charge relay system
source Swiss-Prot : SWS_FT_FI2

14) chain A
residue 86
type BINDING
sequence W
description BINDING => ECO:0007744|PDB:4EY5
source Swiss-Prot : SWS_FT_FI3

15) chain A
residue 133
type BINDING
sequence Y
description BINDING => ECO:0007744|PDB:4EY5
source Swiss-Prot : SWS_FT_FI3

16) chain A
residue 337
type BINDING
sequence Y
description BINDING => ECO:0007744|PDB:4EY5
source Swiss-Prot : SWS_FT_FI3

17) chain A
residue 122
type BINDING
sequence G
description BINDING => ECO:0007744|PDB:4BDT
source Swiss-Prot : SWS_FT_FI4

18) chain A
residue 203
type BINDING
sequence S
description BINDING => ECO:0007744|PDB:4BDT
source Swiss-Prot : SWS_FT_FI4

19) chain A
residue 439
type BINDING
sequence W
description BINDING => ECO:0007744|PDB:4BDT
source Swiss-Prot : SWS_FT_FI4

20) chain A
residue 447
type BINDING
sequence H
description BINDING => ECO:0007744|PDB:4BDT
source Swiss-Prot : SWS_FT_FI4

21) chain A
residue 202
type BINDING
sequence E
description BINDING => ECO:0007744|PDB:4EY6
source Swiss-Prot : SWS_FT_FI5

22) chain A
residue 265
type CARBOHYD
sequence N
description N-linked (GlcNAc...) asparagine => ECO:0000269|PubMed:23035744, ECO:0007744|PDB:4EY4, ECO:0007744|PDB:4EY5, ECO:0007744|PDB:4EY6, ECO:0007744|PDB:4EY7
source Swiss-Prot : SWS_FT_FI6

23) chain A
residue 464
type CARBOHYD
sequence N
description N-linked (GlcNAc...) asparagine => ECO:0000269|PubMed:23035744, ECO:0007744|PDB:4EY8
source Swiss-Prot : SWS_FT_FI8

24) chain A
residue 350
type CARBOHYD
sequence N
description N-linked (GlcNAc...) asparagine => ECO:0000269|PubMed:11053835, ECO:0000269|PubMed:20408548, ECO:0000269|PubMed:23035744, ECO:0000269|PubMed:23679855, ECO:0007744|PDB:1B41, ECO:0007744|PDB:1F8U, ECO:0007744|PDB:2X8B, ECO:0007744|PDB:4BDT, ECO:0007744|PDB:4EY4, ECO:0007744|PDB:4EY5, ECO:0007744|PDB:4EY6, ECO:0007744|PDB:4EY7, ECO:0007744|PDB:4EY8
source Swiss-Prot : SWS_FT_FI7

25) chain A
residue 190-205
type prosite
sequence FGGDPTSVTLFGESAG
description CARBOXYLESTERASE_B_1 Carboxylesterases type-B serine active site. FGGdptsVtLfGeSAG
source prosite : PS00122

26) chain A
residue 94-104
type prosite
sequence EDCLYLNVWTP
description CARBOXYLESTERASE_B_2 Carboxylesterases type-B signature 2. EDCLYLNVWtP
source prosite : PS00941


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