DrugDomain

Attributes

UniProt ID

P29274

Protein Name

Adenosine receptor A2a

Ligand Name

CHOLESTEROL

DrugBank ID

DB04540

PDB Ligand Accession

CLR

ChEMBL ID

n/a

PubChem ID

n/a

InChIKey

HVYWMOMLDIMFJA-DPAQBDIFSA-N

SMILES

CC(C)CCCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C

Drug Action

No data available

Affinity Metrics

No affinity data available

3D Structure

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Mol*

Structure: 4EIY

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Color Legend

Unassigned regionsLigand / hetero atomse4eiyA2e4eiyA3

ECOD domains from experimental PDB structures interacting with ligand DB04540

UniProt	DrugBank	PDB Ligand	PDB ID	ECOD Domain	Range Definition
P29274	DB04540	CLR	4eiy	e4eiyA3	A:-1-1005,A:221-307
P29274	DB04540	CLR	5iu4	e5iu4A1	A:-1-1005,A:221-305
P29274	DB04540	CLR	5iu7	e5iu7A1	A:-3-1005,A:221-307
P29274	DB04540	CLR	5iu8	e5iu8A2	A:-1-1005,A:221-305
P29274	DB04540	CLR	5iua	e5iuaA2	A:-1-1005,A:221-306
P29274	DB04540	CLR	5iub	e5iubA2	A:-1-1005,A:221-305
P29274	DB04540	CLR	5jtb	e5jtbA1	A:-1-1005,A:221-307
P29274	DB04540	CLR	5k2a	e5k2aA2	A:-2-1005,A:221-308
P29274	DB04540	CLR	5k2b	e5k2bA1	A:-2-1005,A:221-308
P29274	DB04540	CLR	5k2c	e5k2cA1	A:-2-1005,A:221-308
P29274	DB04540	CLR	5k2d	e5k2dA2	A:-2-1005,A:221-308
P29274	DB04540	CLR	5mzj	e5mzjA1	A:0-1005,A:221-305
P29274	DB04540	CLR	5mzp	e5mzpA1	A:0-1005,A:221-305
P29274	DB04540	CLR	5n2r	e5n2rA1	A:-1-1005,A:221-305
P29274	DB04540	CLR	5nm2	e5nm2A1	A:-1-1005,A:221-305
P29274	DB04540	CLR	5nm4	e5nm4A2	A:9-222,A:326-409
P29274	DB04540	CLR	5olg	e5olgA2	A:-1-1005,A:221-305
P29274	DB04540	CLR	5olh	e5olhA2	A:-1-1005,A:221-305
P29274	DB04540	CLR	5olo	e5oloA2	A:-1-1005,A:221-305
P29274	DB04540	CLR	5olv	e5olvA2	A:-1-1005,A:221-305
P29274	DB04540	CLR	5olz	e5olzA1	A:-1-1005,A:221-305
P29274	DB04540	CLR	5om1	e5om1A2	A:-2-1005,A:221-305
P29274	DB04540	CLR	5om4	e5om4A2	A:-1-1005,A:221-307
P29274	DB04540	CLR	5uvi	e5uviA2	A:-2-1005,A:221-308
P29274	DB04540	CLR	5vra	e5vraA2	A:-1-1005,A:221-307
P29274	DB04540	CLR	6aqf	e6aqfA1	A:-2-1005,A:221-306
P29274	DB04540	CLR	6gt3	e6gt3A2	A:-1-1005,A:221-305
P29274	DB04540	CLR	6jzh	e6jzhA1	A:-1-1005,A:221-308
P29274	DB04540	CLR	6lpj	e6lpjA2	A:-1-1005,A:221-307
P29274	DB04540	CLR	6lpk	e6lpkA2	A:-1-1005,A:221-307
P29274	DB04540	CLR	6lpl	e6lplA2	A:-1-1005,A:221-307
P29274	DB04540	CLR	6ps7	e6ps7A1	A:-2-1005,A:221-308
P29274	DB04540	CLR	6s0l	e6s0lA2	A:-1-1005,A:221-305
P29274	DB04540	CLR	6s0q	e6s0qA1	A:-1-1005,A:221-305
P29274	DB04540	CLR	6wqa	e6wqaA1	A:-2-1005,A:221-308
P29274	DB04540	CLR	6zdv	e6zdvA1	A:0-1005,A:221-305
P29274	DB04540	CLR	7aro	e7aroA1	A:-1-1005,A:221-305
P29274	DB04540	CLR	7px4	e7px4A1	A:-2-1005,A:221-305
P29274	DB04540	CLR	7pyr	e7pyrA2	A:-2-1005,A:221-305
P29274	DB04540	CLR	7rm5	e7rm5A2	A:-1-1005,A:221-307
P29274	DB04540	CLR	8a2o	e8a2oA1	A:0-1005,A:221-305
P29274	DB04540	CLR	8a2p	e8a2pA1	A:0-1005,A:221-305
P29274	DB04540	CLR	8c9w	e8c9wA1	A:-1-1005,A:221-307
P29274	DB04540	CLR	8cic	e8cicA1	A:-1-1005,A:221-305
P29274	DB04540	CLR	8cu6	e8cu6A2	A:0-1005,A:221-308
P29274	DB04540	CLR	8cu7	e8cu7A2	A:-3-1005,A:221-308
P29274	DB04540	CLR	8du3	e8du3A1	A:0-1005,A:221-306
P29274	DB04540	CLR	8fyn	e8fynA1	A:-1-1005,A:221-307
P29274	DB04540	CLR	8gne	e8gneA2	A:-1-1005,A:221-309
P29274	DB04540	CLR	8jwy	e8jwyA1	A:3-215,A:370-457
P29274	DB04540	CLR	8jwz	e8jwzA2	A:3-215,A:370-457
P29274	DB04540	CLR	8pwn	e8pwnA2	A:25-238,A:342-429