Structure of PDB 6t0v Chain B Binding Site BS04
Receptor Information
>6t0v Chain B (length=745) Species:
1129347
(Influenza A virus (A/little yellow-shouldered bat/Guatemala/060/2010(H17N10))) [
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MDVNPMLIFLKVPVQNAISTTFPYTGDPPYSHGTGTGYTMDTVIRTHDYS
SRGIWKTNSETGAQQLNPIDGPLPEDNEPSGYAQTDCVLELIEGLDRSHP
GLFETACQETIDAIQQTRVDKLTQGRQTYDWTLNRNQPAATALANTIEVF
RKNGYKLNESGRLIDFLKDVLLSFENDSMEVTTHFQKKKRIRDNHSKKMI
TQRTIGKKRVKLTKKNYLIRALTLNTMTKDAERGKLKRRAIATPGMQIRG
FVYFVELLARNICERLEQSGLPVGGNEKKAKLANVIKKMMAKSTDEELSY
TITGDNTKWNENQNPRIFLAMVLRITAGQPEWFRDLLAVAPIMFSNKVAR
LGRGYMFESKSMHLRTQISAENLSDINLRYFNEDTKKKIEKIRHLMVEGT
ASLSPGMMMGMFNMLSTVLGVSVLNLGQREILKRTYWWDGLQSSDDFALI
INGHFKEDIQQGVNHFYRTCKLVGINMSQKKSYINKTGTFEFTSFFYRYG
FVANFSMELPSFGVAGNNESADMSIGTTVIKTNMINNDLGPATAQMAIQL
FIKDYRYTYRCHRGDTNLETRRTKSIKRLWTETISKAGLLVADGGPNPYN
LRNLHIPEVCLKWSLMDPDYRGRLCNPNNPFVHHMEVESTKSLEYDAVAT
THSWTPKRNRSILNTNQRGILEDERIYQKCCQVFEKFFPSSTYRRPIGMA
SMLDAMLSRARIDARIDLESGRISSQDFSEITNTCKAIEALKRQG
Ligand information
Ligand ID
2KH
InChI
InChI=1S/C9H16N3O14P3/c13-5-1-2-12(9(16)10-5)8-7(15)6(14)4(25-8)3-24-27(17,18)11-28(19,20)26-29(21,22)23/h1-2,4,6-8,14-15H,3H2,(H,10,13,16)(H2,21,22,23)(H3,11,17,18,19,20)/t4-,6-,7-,8-/m1/s1
InChIKey
OZIBFYOFLVBDIY-XVFCMESISA-N
SMILES
Software
SMILES
OpenEye OEToolkits 1.7.6
C1=CN(C(=O)NC1=O)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(NP(=O)(O)OP(=O)(O)O)O)O)O
ACDLabs 12.01
O=P(O)(O)OP(=O)(O)NP(=O)(O)OCC2OC(N1C(=O)NC(=O)C=C1)C(O)C2O
CACTVS 3.385
O[CH]1[CH](O)[CH](O[CH]1CO[P](O)(=O)N[P](O)(=O)O[P](O)(O)=O)N2C=CC(=O)NC2=O
CACTVS 3.385
O[C@H]1[C@@H](O)[C@@H](O[C@@H]1CO[P](O)(=O)N[P](O)(=O)O[P](O)(O)=O)N2C=CC(=O)NC2=O
OpenEye OEToolkits 1.7.6
C1=CN(C(=O)NC1=O)C2C(C(C(O2)COP(=O)(NP(=O)(O)OP(=O)(O)O)O)O)O
Formula
C9 H16 N3 O14 P3
Name
5'-O-[(S)-hydroxy{[(S)-hydroxy(phosphonooxy)phosphoryl]amino}phosphoryl]uridine
ChEMBL
DrugBank
ZINC
ZINC000098208190
PDB chain
6t0v Chain B Residue 801 [
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Receptor-Ligand Complex Structure
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PDB
6t0v
A Structure-Based Model for the Complete Transcription Cycle of Influenza Polymerase.
Resolution
3.02 Å
Binding residue
(original residue number in PDB)
K229 R239 D305 N306 K308 W309 N310 M409 G410 D445
Binding residue
(residue number reindexed from 1)
K229 R239 D305 N306 K308 W309 N310 M409 G410 D445
Annotation score
1
Enzymatic activity
Enzyme Commision number
2.7.7.48
: RNA-directed RNA polymerase.
Gene Ontology
Molecular Function
GO:0000166
nucleotide binding
GO:0003723
RNA binding
GO:0003968
RNA-dependent RNA polymerase activity
GO:0034062
5'-3' RNA polymerase activity
Biological Process
GO:0001172
RNA-templated transcription
GO:0019083
viral transcription
GO:0039523
symbiont-mediated suppression of host mRNA transcription via inhibition of RNA polymerase II activity
GO:0039694
viral RNA genome replication
Cellular Component
GO:0005737
cytoplasm
GO:0030430
host cell cytoplasm
GO:0042025
host cell nucleus
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Molecular Function
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Biological Process
View graph for
Cellular Component
External links
PDB
RCSB:6t0v
,
PDBe:6t0v
,
PDBj:6t0v
PDBsum
6t0v
PubMed
32304664
UniProt
H6QM91
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