Structure of PDB 8snl Chain A Binding Site BS01

Receptor Information

>8snl Chain A (length=656) Species: 9606 (Homo sapiens) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]

PHQRLEKLDSLLSDYDILSLSNIQQHSVRKRDLQTSTHVETLLTFSALKR
HFKLYLTSSTERFSQNFKVVVVDGKNESEYTVKWQDFFTGHVVGEPDSRV
LAHIRDDDVIIRINTDGAEYNIEPLWRFVNDTKDKRMLVYKSEDIKNVSR
LQSPKVCGYLKVDNEELLPKGLVDREDPMKNTCKLLVVADHRFYRYMGRG
EESTTTNYLIELIDRVDDIYRNTSWDNAGFKGYGIQIEQIRILKSPQEVK
PGEKHYNMAKSYPNEEKDAWDVKMLLEQFSFDIAEEASKVCLAHLFTYQD
FDMGTLGLAYVGSPRANSHGGVCPKAYYSPVGKKNIYLNSGLTSTKNYGK
TILTKEADLVTTHELGHNFGAEHDPDGLAECAPNEDQGGKYVMYPIAVSG
DHENNKMFSNCSKQSIYKTIESKAQECFQERSNKVCGNSRVDEGEECDPG
IMYLNNDTCCNSDCTLKEGVQCSDRNSPCCKNCQFETAQKKCQEAINATC
KGVSYCTGNSSECPPPGNAEDDTVCLDLGKCKDGKCIPFCEREQQLESCA
CNETDNSCKVCCRDLSGRCVPYVDAEQKNLFLRKGKPCTVGFCDMNGKCE
KRVQDVIERFWDFIDQLSINTFGKFLADNIVGSVLVFSLIFWIPFSILVH
CVDKKL

Ligand information

Ligand ID

InChI

InChI=1S/Zn/q+2

InChIKey

PTFCDOFLOPIGGS-UHFFFAOYSA-N

SMILES

Software	SMILES
CACTVS 3.341	[Zn++]
ACDLabs 10.04 OpenEye OEToolkits 1.5.0	[Zn+2]

Formula

Name

ZINC ION

PDB chain

8snl Chain A Residue 901 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]

Receptor-Ligand Complex Structure

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Structure summary

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PDB	8snl Structure of human ADAM17/iRhom2 sheddase complex
Resolution	2.78 Å
Binding residue (original residue number in PDB)	H405 H409 H415
Binding residue (residue number reindexed from 1)	H363 H367 H373
Annotation score	4

Enzymatic activity

Enzyme Commision number

3.4.24.86: ADAM 17 endopeptidase.

External links

PDB	RCSB:8snl, PDBe:8snl, PDBj:8snl
PDBsum	8snl
PubMed
UniProt	P78536\|ADA17_HUMAN Disintegrin and metalloproteinase domain-containing protein 17 (Gene Name=ADAM17)

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