DrugDomain

Attributes

UniProt ID

P03366

Protein Name

Gag-Pol polyprotein

Ligand Name

4-{[4-({4-[(E)-2-cyanoethenyl]-2,6-dimethylphenyl}amino)pyrimidin-2-yl]amino}benzonitrile

DrugBank ID

DB08864

PDB Ligand Accession

T27

ChEMBL ID

n/a

PubChem ID

n/a

InChIKey

YIBOMRUWOWDFLG-ONEGZZNKSA-N

SMILES

Cc1cc(cc(c1Nc2ccnc(n2)Nc3ccc(cc3)C#N)C)C=CC#N

Drug Action

No data available

Affinity Metrics

No affinity data available

3D Structure

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Mol*

Structure: 2ZD1

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Color Legend

Unassigned regionsLigand / hetero atomse2zd1A3e2zd1A5e2zd1A6e2zd1A7e2zd1B1e2zd1B2e2zd1B3

ECOD domains from experimental PDB structures interacting with ligand DB08864

UniProt	DrugBank	PDB Ligand	PDB ID	ECOD Domain	Range Definition
P03366	DB08864	T27	2zd1	e2zd1A5	A:317-428
P03366	DB08864	T27	2zd1	e2zd1A7	A:-1-239
P03366	DB08864	T27	2zd1	e2zd1B2	B:5-242
P03366	DB08864	T27	2ze2	e2ze2A5	A:317-428
P03366	DB08864	T27	2ze2	e2ze2A7	A:1-239
P03366	DB08864	T27	2ze2	e2ze2B2	B:5-241
P03366	DB08864	T27	3bgr	e3bgrA5	A:317-428
P03366	DB08864	T27	3bgr	e3bgrA7	A:-1-239
P03366	DB08864	T27	3bgr	e3bgrB2	B:5-241
P03366	DB08864	T27	3qlh	e3qlhA5	A:317-428
P03366	DB08864	T27	3qlh	e3qlhA7	A:0-240
P03366	DB08864	T27	3qlh	e3qlhB6	B:6-230
P03366	DB08864	T27	4g1q	e4g1qA5	A:317-428
P03366	DB08864	T27	4g1q	e4g1qA7	A:-1-239
P03366	DB08864	T27	4g1q	e4g1qB6	B:5-230
P03366	DB08864	T27	4icl	e4iclA5	A:317-428
P03366	DB08864	T27	4icl	e4iclA8	A:-1-239
P03366	DB08864	T27	4icl	e4iclB5	B:5-230
P03366	DB08864	T27	4id5	e4id5A5	A:317-428
P03366	DB08864	T27	4id5	e4id5A8	A:-1-239
P03366	DB08864	T27	4id5	e4id5B5	B:5-230
P03366	DB08864	T27	4idk	e4idkA5	A:317-428
P03366	DB08864	T27	4idk	e4idkA8	A:-1-239
P03366	DB08864	T27	4idk	e4idkB5	B:5-230
P03366	DB08864	T27	4ifv	e4ifvA5	A:317-428
P03366	DB08864	T27	4ifv	e4ifvA8	A:-1-239
P03366	DB08864	T27	4ifv	e4ifvB5	B:5-230
P03366	DB08864	T27	4ify	e4ifyA5	A:317-428
P03366	DB08864	T27	4ify	e4ifyA8	A:-1-239
P03366	DB08864	T27	4ify	e4ifyB5	B:5-230
P03366	DB08864	T27	4ig3	e4ig3A5	A:317-428
P03366	DB08864	T27	4ig3	e4ig3A8	A:-1-239
P03366	DB08864	T27	4ig3	e4ig3B6	B:5-230
P03366	DB08864	T27	4kfb	e4kfbA5	A:317-428
P03366	DB08864	T27	4kfb	e4kfbA7	A:-1-239
P03366	DB08864	T27	4kfb	e4kfbB9	B:5-218
P03366	DB08864	T27	5cym	e5cymA1	A:-1-239
P03366	DB08864	T27	5cym	e5cymA3	A:317-428
P03366	DB08864	T27	5cym	e5cymB2	B:5-241
P03366	DB08864	T27	5cyq	e5cyqA3	A:317-428
P03366	DB08864	T27	5cyq	e5cyqA4	A:-1-239
P03366	DB08864	T27	5cyq	e5cyqB3	B:5-241
P03366	DB08864	T27	6eli	e6eliA1	A:-1-239
P03366	DB08864	T27	6eli	e6eliA4	A:317-428
P03366	DB08864	T27	6eli	e6eliB2	B:5-230
P03366	DB08864	T27	7z2d	e7z2dA3	A:0-239
P03366	DB08864	T27	7z2d	e7z2dA4	A:317-428
P03366	DB08864	T27	7z2d	e7z2dB1	B:4-241
P03366	DB08864	T27	7z2e	e7z2eA1	A:317-428
P03366	DB08864	T27	7z2e	e7z2eA3	A:0-239
P03366	DB08864	T27	7z2e	e7z2eB2	B:4-230
P03366	DB08864	T27	8dx2	e8dx2A2	A:-1-239
P03366	DB08864	T27	8dx2	e8dx2A4	A:317-428
P03366	DB08864	T27	8dx2	e8dx2B3	B:5-230
P03366	DB08864	T27	8dx3	e8dx3A1	A:317-428
P03366	DB08864	T27	8dx3	e8dx3A2	A:-1-239
P03366	DB08864	T27	8dx3	e8dx3B1	B:5-230
P03366	DB08864	T27	8dx8	e8dx8A1	A:-1-239
P03366	DB08864	T27	8dx8	e8dx8A3	A:317-428
P03366	DB08864	T27	8dx8	e8dx8B1	B:5-230
P03366	DB08864	T27	8dxb	e8dxbA2	A:-1-239
P03366	DB08864	T27	8dxb	e8dxbA4	A:317-428
P03366	DB08864	T27	8dxb	e8dxbB2	B:5-230
P03366	DB08864	T27	8dxe	e8dxeA1	A:-1-239
P03366	DB08864	T27	8dxe	e8dxeA2	A:317-428
P03366	DB08864	T27	8dxe	e8dxeB2	B:5-230
P03366	DB08864	T27	8dxg	e8dxgA1	A:-1-239
P03366	DB08864	T27	8dxg	e8dxgA4	A:317-428
P03366	DB08864	T27	8dxg	e8dxgB3	B:5-230
P03366	DB08864	T27	8dxh	e8dxhA1	A:317-428
P03366	DB08864	T27	8dxh	e8dxhA3	A:-1-239
P03366	DB08864	T27	8dxh	e8dxhB1	B:5-230
P03366	DB08864	T27	8dxi	e8dxiA2	A:-1-239
P03366	DB08864	T27	8dxi	e8dxiA3	A:317-428
P03366	DB08864	T27	8dxi	e8dxiB1	B:5-230
P03366	DB08864	T27	8dxj	e8dxjA1	A:-1-239
P03366	DB08864	T27	8dxj	e8dxjA4	A:317-428
P03366	DB08864	T27	8dxj	e8dxjB1	B:5-230
P03366	DB08864	T27	8dxk	e8dxkA2	A:317-428
P03366	DB08864	T27	8dxk	e8dxkA4	A:-1-239
P03366	DB08864	T27	8dxk	e8dxkB3	B:5-230
P03366	DB08864	T27	8dxl	e8dxlA1	A:317-428
P03366	DB08864	T27	8dxl	e8dxlA2	A:-1-239
P03366	DB08864	T27	8dxl	e8dxlB3	B:5-230
P03366	DB08864	T27	8dxm	e8dxmA2	A:317-428
P03366	DB08864	T27	8dxm	e8dxmA3	A:-1-239
P03366	DB08864	T27	8dxm	e8dxmB2	B:5-230