eF-site ID 1c8m-1234
PDB Code 1c8m
Chain 1, 2, 3, 4

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Title REFINED CRYSTAL STRUCTURE OF HUMAN RHINOVIRUS 16 COMPLEXED WITH VP63843 (PLECONARIL), AN ANTI-PICORNAVIRAL DRUG CURRENTLY IN CLINICAL TRIALS
Classification VIRUS
Compound HUMAN RHINOVIRUS 16 COAT PROTEIN
Source ORGANISM_SCIENTIFIC: Human rhinovirus 16;
Sequence 1:  NPVERYVDEVLNEVLVVPNINQSHPTTSNAAPVLDAAETG
HTNKIQPEDTIETRYVQSSQTLDEMSVESFLGRSGCIHES
VLDIVDNYNDQSFTKWNINLQEMAQIRRKFEMFTYARFDS
EITMVPSVAAKDGHIGHIVMQYMYVPPGAPIPTTRDDYAW
QSGTNASVFWQHGQPFPRFSLPFLSIASAYYMFYDGYDGD
TYKSRYGTVVTNDMGTLCSRIVTSEQLHKVKVVTRIYHKA
KHTKAWCPRPPRAVQYSHTHTTNYKLSSEVHNDVAIRPRT
NLTTV
2:  SDRIIQITRGDSTITSQDVANAVVGYGVWPHYLTPQDATA
IDKPTQPDTSSNRFYTLDSKMWNSTSKGWWWKLPDALKDM
GIFGENMFYHFLGRSGYTVHVQCNASKFHQGTLLVVMIPE
HQLATVNKGNVNAGYKYTHPGEAGREVGTQVENEKQPSDD
NWLNFDGTLLGNLLIFPHQFINLRSNNSATLIVPYVNAVP
MDSMVRHNNWSLVIIPVCQLQSNNISNIVPITVSISPMCA
EFSGARAKTVVQ
3:  GLPVYVTPGSGQFMTTDDMQSPCALPWYHPTKEIFIPGEV
KNLIEMCQVDTLIPINSTQSNIGNVSMYTVTLSPQTKLAE
EIFAIKVDIASHPLATTLIGEIASYFTHWTGSLRFSFMFC
GTANTTLKVLLAYTPPGIGKPRSRKEAMLGTHVVWDVGLQ
STVSLVVPWISASQYRFTTPDTYSSAGYITCWYQTNFVVP
PNTPNTAEMLCFVSGCKDFCLRMARDTDLHKQTGPITQ
4:  GAQVSRQSINYFNINYFKDAASSGASRLD
Description


Functional site

1) chain 1
residue 134
type
sequence H
description PUTATIVE ZINC BINDING SITE ON ICOSAHEDRAL FIVE-FOLD AXIS. ION LIGANDED BY FIVE SYMMETRY RELATED HISTIDINES (HIS 1 134). EXTERIOR OF SITE SURROUNDED BY A WIDER CIRCLE OF FIVE HISTIDINES (HIS 2 228)
source : ION

2) chain 1
residue 228
type
sequence H
description PUTATIVE ZINC BINDING SITE ON ICOSAHEDRAL FIVE-FOLD AXIS. ION LIGANDED BY FIVE SYMMETRY RELATED HISTIDINES (HIS 1 134). EXTERIOR OF SITE SURROUNDED BY A WIDER CIRCLE OF FIVE HISTIDINES (HIS 2 228)
source : ION

3) chain 2
residue 38
type
sequence W
description RNA OBSERVED INTERACTING WITH THESE RESIDUES ON THE INTERIOR SURFACE OF VIRAL PROTEIN CAPSID. NON-CONSERVATIVE MUTATION OF TRP 2 38 GIVES NON-VIABLE VIRUS.
source : RNA

4) chain 3
residue 35
type
sequence F
description RNA OBSERVED INTERACTING WITH THESE RESIDUES ON THE INTERIOR SURFACE OF VIRAL PROTEIN CAPSID. NON-CONSERVATIVE MUTATION OF TRP 2 38 GIVES NON-VIABLE VIRUS.
source : RNA

5) chain 1
residue 179
type
sequence F
description AN ANTIVIRAL COMPOUND IS FOUND IN A POCKET OF VP1
source : POC

6) chain 1
residue 214
type
sequence M
description AN ANTIVIRAL COMPOUND IS FOUND IN A POCKET OF VP1
source : POC

7) chain 1
residue 217
type
sequence L
description AN ANTIVIRAL COMPOUND IS FOUND IN A POCKET OF VP1
source : POC

8) chain 1
residue 134
type
sequence H
description BINDING SITE FOR RESIDUE ZN 1 6000
source : AC1

9) chain 1
residue 77
type
sequence I
description BINDING SITE FOR RESIDUE W11 1 7001
source : AC2

10) chain 1
residue 98
type
sequence I
description BINDING SITE FOR RESIDUE W11 1 7001
source : AC2

11) chain 1
residue 100
type
sequence L
description BINDING SITE FOR RESIDUE W11 1 7001
source : AC2

12) chain 1
residue 124
type
sequence M
description BINDING SITE FOR RESIDUE W11 1 7001
source : AC2

13) chain 1
residue 142
type
sequence Y
description BINDING SITE FOR RESIDUE W11 1 7001
source : AC2

14) chain 1
residue 143
type
sequence M
description BINDING SITE FOR RESIDUE W11 1 7001
source : AC2

15) chain 1
residue 144
type
sequence Y
description BINDING SITE FOR RESIDUE W11 1 7001
source : AC2

16) chain 1
residue 166
type
sequence A
description BINDING SITE FOR RESIDUE W11 1 7001
source : AC2

17) chain 1
residue 168
type
sequence V
description BINDING SITE FOR RESIDUE W11 1 7001
source : AC2

18) chain 1
residue 179
type
sequence F
description BINDING SITE FOR RESIDUE W11 1 7001
source : AC2

19) chain 1
residue 181
type
sequence L
description BINDING SITE FOR RESIDUE W11 1 7001
source : AC2

20) chain 1
residue 184
type
sequence L
description BINDING SITE FOR RESIDUE W11 1 7001
source : AC2

21) chain 1
residue 190
type
sequence Y
description BINDING SITE FOR RESIDUE W11 1 7001
source : AC2

22) chain 1
residue 212
type
sequence N
description BINDING SITE FOR RESIDUE W11 1 7001
source : AC2

23) chain 1
residue 214
type
sequence M
description BINDING SITE FOR RESIDUE W11 1 7001
source : AC2

24) chain 1
residue 217
type
sequence L
description BINDING SITE FOR RESIDUE W11 1 7001
source : AC2

25) chain 4
residue 2
type LIPID
sequence A
description N-myristoyl glycine; by host => ECO:0000250|UniProtKB:P03300
source Swiss-Prot : SWS_FT_FI2


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