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GLASS

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GPCR

Name	Beta-2 adrenergic receptor
Species	Rattus norvegicus (Rat)
Gene	Adrb2
Synonym	beta2-adrenoceptor Beta-2 adrenoreceptor Beta-2 adrenoceptor beta-2 adrenergic receptor beta 2-AR B2AR adrenoceptor beta 2, surface adrenergic receptor ADRBR ADRB2R Adrb-2 Gpcr7 [ Show all ]
Disease	N/A for non-human GPCRs
Length	418
Amino acid sequence	MEPHGNDSDFLLAPNGSRAPGHDITQERDEAWVVGMAILMSVIVLAIVFGNVLVITAIAKFERLQTVTNYFITSLACADLVMGLAVVPFGASHILMKMWNFGNFWCEFWTSIDVLCVTASIETLCVIAVDRYVAITSPFKYQSLLTKNKARVVILMVWIVSGLTSFLPIQMHWYRATHKQAIDCYAKETCCDFFTNQAYAIASSIVSFYVPLVVMVFVYSRVFQVAKRQLQKIDKSEGRFHAQNLSQVEQDGRSGHGLRSSSKFCLKEHKALKTLGIIMGTFTLCWLPFFIVNIVHVIRANLIPKEVYILLNWLGYVNSAFNPLIYCRSPDFRIAFQELLCLRRSSSKTYGNGYSSNSNGRTDYTGEQSAYQLGQEKENELLCEEAPGMEGFVNCQGTVPSLSIDSQGRNCNTNDSPL
UniProt	P10608
Protein Data Bank	N/A
GPCR-HGmod model	N/A
3D structure model	No available structures or models
BioLiP	N/A
Therapeutic Target Database	N/A
ChEMBL	CHEMBL3754
IUPHAR	29
DrugBank	N/A

Ligand

Name	DL-CYSTINE
Molecular formula	C6H12N2O4S2
IUPAC name	2-amino-3-[(2-amino-2-carboxyethyl)disulfanyl]propanoic acid
Molecular weight	240.292
Hydrogen bond acceptor	8
Hydrogen bond donor	4
XlogP	-6.3
Synonyms	AKOS000121517 ANW-43036 C6H12N2O4S2 Cystin Dicysteine K684 .beta.,.beta.'-dicarboxydiethyl disulfide NCGC00164531-01 2-amino-3-[(2-amino-3-hydroxy-3-oxo-propyl)disulfanyl]propanoic acid NSC13203 3055-EP2287152A2 PubChem12373 923C320 STL163324 Alanine,3'-dithiodi- BDBM86199 CHEBI:17376 Cystine, DL- DL-Cystine, free base (+)-3,3'-DITHIO-bis-(2-AMINOPROPIONIC) L-3,3'-dithiodialanine .beta.,.beta.'-Dithiodialanine NE11203 3,3'-Dithiobis (2-aminopropanoic acid) NSC755897 4CH-013472 SCHEMBL10224 AC1Q28K0 VA50617 AN-44446 C-9765 CTK3I6828 Cystine_RamanathanGurudeeban GM5088 MFCD00084652 2-amino-3-[(2-amino-2-carboxy-ethyl)disulfanyl]propionic acid NSC-205366 3055-EP2272973A1 Pharmakon1600-01300099 90350-38-2 ST2417205 ACMC-209luu AKOS016050601 AX8035437 CAS_595 cystine KB-50299 .beta.,.beta.'-dicarboxydiethyldisulfide NCGC00164531-02 2-amino-3-[(2-amino-3-hydroxy-3-oxopropyl)disulfanyl]propanoic acid NSC203781 3055-EP2295410A1 RTC-066536 AB1007082 TC-066536 Z56346947 alpha-Diamino-beta-dithiolactic acid Bis(.beta.-amino-.beta.-carboxyethyl) disulfide CHEMBL366563 Cystine, L- EN300-34180 (+/-)-3,3'-Dithiobis(2-aminopropionicacid) LEVWYRKDKASIDU-UHFFFAOYSA-N 2-amino-3-(2-amino-3-hydroxy-3-oxopropyl)disulfanylpropansäure NSC-13203 3,3'-Dithiobis(2-aminopropionic acid) NSC_595 5228F255-51E7-421E-8A05-4687B20118CB SR-01000872746 ACMC-1AZ5O AN-47975 C01420 Cystein disulfide D-Cystine I14-5269 .beta.,.beta.'-Diamino-.beta.,.beta.'-dicarboxydiethyl disulfide MolPort-001-779-797 2-amino-3-[(2-amino-2-carboxyethyl)disulfanyl]propanoic acid NSC-755897 3055-EP2277872A1 Propanoic acid,3'-dithiobis[2-amino-, [R-(R,R)]- 923-32-0 ST45022122 AK-80477 Alanine,3'-dithiobis- BBL011587 CAS_67678 CYSTINE, (L) DL-Cystine, 99% ( inverted exclamation markA)-3,3 inverted exclamation marka-Dithiobis(2-aminopropionicacid) KS-00000YBE .beta.,.beta.'-Dithiobisalanine NCGC00164531-03 3,3'-disulfanediylbis(2-aminopropanoic acid) NSC205366 3055-EP2301939A1 SBI-0207067.P001 AC1L19KY TRA0048972 Zystin AM81645 Bis(.beta.-amino-.beta.-carboxyethyl)disulfide cistina Cystine,(S) FT-0625453 (H-DL-Cys-OH)2 MCULE-2293704247 2-amino-3-[(2-amino-2-carboxy-ethyl)disulfanyl]propanoic acid NSC-203781 3055-EP2272972A1 NSC_67678 SR-01000872746-1 ACMC-209ibx [ Show all ]
Inchi Key	LEVWYRKDKASIDU-UHFFFAOYSA-N
Inchi ID	InChI=1S/C6H12N2O4S2/c7-3(5(9)10)1-13-14-2-4(8)6(11)12/h3-4H,1-2,7-8H2,(H,9,10)(H,11,12)
PubChem CID	595
ChEMBL	N/A
IUPHAR	N/A
BindingDB	86199
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Experimental Data

Parameter	Value	Reference	Database source
Ki	<10000.0 nM	PMID12649361	BindingDB

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