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COVID-19-genome

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SARS-CoV-2 protein components. Summary and comments of PDB entries

Protein component

Function

PDB ID and link

Resolution method

Ligand

Nsp1

It suppresses host gene expression by ribosome association. It blocks the innate immune responses that would otherwise facilitate clearance of the infection

6ZLW

Electron Microscopy

human 40S ribosomal subunit

6ZM7

Electron Microscopy

human CCDC124-80S-EBP1 ribosome complex

6ZME

Electron Microscopy

human CCDC124-80S-eERF1 ribosome complex

6ZMI

Electron Microscopy

human LYAR-80S ribosome complex

6ZMT

Electron Microscopy

pre-40S-like ribosome complex

6ZN5

Electron Microscopy

pre-40S-like ribosome complex - state 2

6ZP4

Electron Microscopy

human 43S preinitiation ribosome complex - state 2

Nsp2

Nsp2, along with nsp1, are involved in suppressing gene expression

-

 

 

Nsp3

Involved in viral replication. The Nsp3-4-6 complex regulates the replication site by recruiting the replicase proteins to the host membrane. Nsp3, Nsp4 and Nsp6 assemble at the endoplasmic reticulum, driving its modification and formation of the DMV (double membrane vesicles) Papain-like protease domain

6W6Y

X-Ray Diffraction

AMP (ADENOSINE MONOPHOSPHATE)

6WUU

X-Ray Diffraction

peptide inhibitor VIR250

6W9C

X-Ray Diffraction

 

6VXS

X-Ray Diffraction

 

6W02

X-Ray Diffraction

ADP ribose

6WCF

X-Ray Diffraction

MES, 2-(N-MORPHOLINO)-ETHANESULFONIC ACID

6WEN

X-Ray Diffraction

 

6WEY

X-Ray Diffraction

 

6WRH

X-Ray Diffraction

 

6WX4

X-Ray Diffraction

peptide inhibitor VIR251

6WZU

X-Ray Diffraction

P3221 space group

6XAA

X-Ray Diffraction

ubiquitin propargylamide

6XA9

X-Ray Diffraction

SG15 C-terminal domain propargylamide

6XG3

X-Ray Diffraction

 

6YWK

X-Ray Diffraction

HEPES

6YWL

X-Ray Diffraction

ADP-ribose

6YWM

X-Ray Diffraction

MES, 2-(N-MORPHOLINO)-ETHANESULFONIC ACID

Nsp4

Nsp3-4-6 complex for endoplasmic reticulum modification and formation of DMVs

-

 

 

Nsp5

Main protease

6LU7

X-Ray Diffraction

inhibitor N3

6LZE

X-Ray Diffraction

inhibitor 11a

6M03

X-Ray Diffraction

 

6M0K

X-Ray Diffraction

inhibitor 11b

6M2N

X-Ray Diffraction

novel inhibitor

6M2Q

 

 

6W63

X-Ray Diffraction

non-covalent inhibitor X77

6WTT

X-Ray Diffraction

inhibitor GC-376

6XCH

X-Ray Diffraction

Leupeptin

6WQF

X-Ray Diffraction

 

6XKH

X-Ray Diffraction

Oxidized C145 (sulfinic acid cysteine)

6Y2G

X-Ray Diffraction

α-ketoamide inhibitor.

6Y2E

X-Ray Diffraction

 

6Y2F

X-Ray Diffraction

α-ketoamide inhibitor.

6Y84

X-Ray Diffraction

 

6YB7

X-Ray Diffraction

 

6YNQ

X-Ray Diffraction

2-Methyl-1-tetralone

6YVA

X-Ray Diffraction

mISG15

6YVF

X-Ray Diffraction

AZD6482

6Z2E

X-Ray Diffraction

biotin-PEG(4)-Abu-Tle-Leu-Gln-vinylsulfone

6WNP

X-Ray Diffraction

Boceprevir

6WTK

X-Ray Diffraction

Feline coronavirus drug

6WTM

X-Ray Diffraction

Feline coronavirus drug

6WTJ

X-Ray Diffraction

Feline coronavirus drug

6XA4

X-Ray Diffraction

UAW241

6XB0

X-Ray Diffraction

 

6XB1

X-Ray Diffraction

 

6XB2

X-Ray Diffraction

 

6XBG

X-Ray Diffraction

UAW246

6XBH

X-Ray Diffraction

UAW247

6XBI

X-Ray Diffraction

UAW248

6XHM

X-Ray Diffraction

Ketone-Based Covalent Inhibitors

6XHU

X-Ray Diffraction

 

6XFN

X-Ray Diffraction

UAW243

6XKF

X-Ray Diffraction

oxidized Cys145

6XMK

X-Ray Diffraction

inhibitor 7j

6YZ6

X-Ray Diffraction

Leupeptin

7B83

X-Ray Diffraction

pyrithione zinc

7BRP

X-Ray Diffraction

Boceprevir

7BQY

X-Ray Diffraction

Inhibitor N3

7BUY

X-Ray Diffraction

carmofur

7C8R

X-Ray Diffraction

TG-0203770

7C8T

X-Ray Diffraction

TG-0205221

7C8U

X-Ray Diffraction

GC376

7D1M

X-Ray Diffraction

GC376

Nsp6

Nsp3-4-6 complex for endoplasmic reticulum modification and formation of DMVs

-

 

 

Nsp7-Nsp8-Nsp12

Complex (RNA-dependent RNA polymerase) (RdRp)

Part of the replication-transcription complex, involved in virus replication

6M5I

Electron Microscopy

nsp7-nsp8c complex

6M71

Electron Microscopy

 

6WIQ

Electron Microscopy

nsp7-nsp8c complex

6WQD

Electron Microscopy

nsp7-nsp8c complex

6WTC

Electron Microscopy

nsp7-nsp8c complex

6XEZ

Electron Microscopy

nsp7, nsp8, nsp12 bound to nsp13 

6XIP

Electron Microscopy

nsp7-nsp8c complex

6XQB

Electron Microscopy

nsp7-nsp8c complex

6YHU

Electron Microscopy

nsp7-nsp8c complex

6YYT

Electron Microscopy

 

7AAP

Electron Microscopy

primer dsRNA and favipiravir-RTP

7BTF

Electron Microscopy

 

7BV1

Electron Microscopy

 

7BV2

Electron Microscopy

template-primer RNA and triphosphate form of Remdesivir(RTP)

7BW4

Electron Microscopy

 

7BZF

Electron Microscopy

nsp7-nsp8c complex

7C2K

Electron Microscopy

nsp7-nsp8c complex

Nsp9

RNA replicase

6W9Q

X-Ray Diffraction

 

6W4B

X-Ray Diffraction

 

6WXD

X-Ray Diffraction

 

Nsp10-Nsp16

Nsp10 plays multiple roles in RNA capping

6XKM

X-Ray Diffraction

nsp16-nsp10 with SAM (S-ADENOSYLMETHIONINE)

6W4H

X-Ray Diffraction

nsp16-nsp10 complex

6W61

X-Ray Diffraction

nsp16-nsp10 complex

6W75

X-Ray Diffraction

nsp16-nsp10 complex

6WJT

X-Ray Diffraction

nsp16-nsp10 with  S-Adenosyl-L-Homocysteine

6WQ3

X-Ray Diffraction

nsp16-nsp10 7-methyl-GpppA and S-adenosyl-L-homocysteine

6WKS

X-Ray Diffraction

nsp16-nsp10 with RNA cap analogue (m7GpppA) and S-adenosylmethionine

6WKQ

X-Ray Diffraction

nsp10-nsp16 with Sinefungin

6WRZ

X-Ray Diffraction

nsp16-nsp10 with 7-methyl-GpppA, S-adenosyl-L-homocysteine and Sulfates

6WVN

X-Ray Diffraction

nsp16-nsp10 with 7-methyl-GpppA and S-Adenosylmethionine

6YZ1

X-Ray Diffraction

nsp10-nsp16 with Sinefungin

6ZCT

X-Ray Diffraction

nsp10

7BQ7

X-Ray Diffraction

nsp16-nsp10 complex

7C2I

X-Ray Diffraction

nsp16-nsp10 with SAM

7C2J

X-Ray Diffraction

nsp16-nsp10 with SAM

Nsp11

 

-

 

 

Nsp13

 

6XEZ

Electron Microscopy

nsp7, nsp8, nsp12 bound to nsp13 

Nsp14

 

-

 

 

Nsp15

RNA endonuclease

6VWW

X-Ray Diffraction

 

6W01

X-Ray Diffraction

Citrate

6WLC

X-Ray Diffraction

Uridine-5'-Monophosphate

6WXC

X-Ray Diffraction

Tipiracil

6X1B

X-Ray Diffraction

Nucleotide GpU

6XDH

X-Ray Diffraction

 

S

Spike (S) glycoprotein

6LVN

X-Ray Diffraction

S2 subunit

6LZG

X-Ray Diffraction

Receptor Binding Domain (RBD) of S with ACE2

6LXT

X-Ray Diffraction

S2 subunit

6M0J

X-Ray Diffraction

RBD with ACE2

6M17

Electron Microscopy

RBD with ACE2-B0AT1 complex

6M1V

X-Ray Diffraction

S2 subunit

6ZER

X-Ray Diffraction

RBD with EY6A Fab

6ZGH

Electron Microscopy

 

6ZGG

Electron Microscopy

 

6VSB

Electron Microscopy

 

6VW1

X-Ray Diffraction

RBD with ACE2

6VXX

Electron Microscopy

 

6VYB

Electron Microscopy

 

6W41

X-Ray Diffraction

RBD with CR3022

6WPS

Electron Microscopy

S309 neutralizing antibody Fab fragment

6WPT

Electron Microscopy

S309 neutralizing antibody Fab fragment

6X29

Electron Microscopy

 

6X2A

Electron Microscopy

 

6X2B

Electron Microscopy

 

6X2C

Electron Microscopy

 

6X6P

Electron Microscopy

 

6XC2

X-Ray Diffraction

RBD with antibody CC12.1

6XC3

X-Ray Diffraction

RBD with antibodies CC12.1 and CR3022

6XC4

X-Ray Diffraction

RBD with antibody CC12.3

6XCM

Electron Microscopy

C105 neutralizing antibody Fab fragment (state 1)

6XCN

Electron Microscopy

C105 neutralizing antibody Fab fragment (state 2)

6XDG

Electron Microscopy

RBD with the Fab fragments of two neutralizing antibodies

6XE1

X-Ray Diffraction

RBD with CV30 Fab

6XKL

Electron Microscopy

 

6XR8

Electron Microscopy

 

6XRA

Electron Microscopy

 

6YLA

X-Ray Diffraction

RBD with CR3022 Fab

6YMO

X-Ray Diffraction

RBD with CR3022 Fab

6YOR

Electron Microscopy

S1 unit with CR3022 Fab

6YZ5

X-Ray Diffraction

RBD with nanobody H11-D4

6ZGE

Electron Microscopy

 

6ZGI

Electron Microscopy

 

7BWJ

X-Ray Diffraction

RBD with an antibody

7BYR

Electron Microscopy

BD23-Fab

7C01

X-Ray Diffraction

RBD with CB6 antibody

7C2L

Electron Microscopy

4A8

7DDD

Electron Microscopy

 

7DDN

Electron Microscopy

 

7JWB

Electron Microscopy

Trimerized VH binder

7T9J

Electron Microscopy

SARS-CoV-2 Omicron spike protein

7T9L

Electron Microscopy

SARS-CoV-2 Omicron spike protein in complex with human ACE2

Orf3a

Increased formation of DMVs

6XDC

Electron Microscopy

 

7KJR

Electron Microscopy

Apolipoprotein A-I

Orf3b

Downregulates IFN-I ( Human type I interferons) signaling

-

 

 

Orf6

Interferon antagonist

-

 

 

Orf7a

Favors apoptotic activity of infected cells

6W37

Diffraction

 

Orf7b

Favors apoptotic activity of infected cells

-

 

 

Orf8

Interferes with immune responses

7JTL

X-Ray Diffraction

 

7JX6

X-Ray Diffraction

 

Orf9b

Interferon antagonist

2CME

X-Ray Diffraction

 

6Z4U

X-Ray Diffraction

 

7KDT

Electron Microscopy

Human mitochondrial receptor Tom70

Orf9c

 

-

 

 

Orf10

 

-

 

 

E

Envelope (E) protein, involved in virus packaging

7K3G

Solid-State NMR

 

M

Membrane (M) protein, involved in virus packaging

-

 

 

N

Nucleocapsid (N) protein, involved in RNA binding and packaging

6M3M

X-Ray Diffraction

 

6VYO

X-Ray Diffraction

 

6WKP

X-Ray Diffraction

monoclinic crystal form

6WJI

X-Ray Diffraction

 

6WZO

X-Ray Diffraction

 

6WZQ

X-Ray Diffraction

 

6YI3

NMR

 

6YUN

X-Ray Diffraction

 

6ZCO

X-Ray Diffraction

 

7ACS

NMR

7mer dsRNA

7ACT

NMR

10mer ssRNA

7C22

X-Ray Diffraction

 

7CE0

X-Ray Diffraction

 

7CDZ

X-Ray Diffraction

 

7DE1

X-Ray Diffraction

 

 

Results of the project “Prediction of the structure of SARS-CoV-2 proteins with artificial intelligence techniques”, funded by Axencia Galega de Innovación (GAIN) and co-funded by FEDER, and supported by Consellería de Economía, Emprego e Industria, reference: IN845D-02.

Resultados do proxecto “Predición da estrutura de proteínas de SARS-CoV-2 con técnicas de intelixencia artificial”, subvencionado pola Axencia Galega de Innovación (GAIN) e cofinanciado con cargo aos fondos FEDER, e apoiado pola Consellería de Economía, Emprego e Industria, referencia: IN845D-02.