Structure of PDB 6h5w Chain A

Receptor sequence
>6h5wA (length=586) Species: 9606 (Homo sapiens) [Search protein sequence]
DEAEASKFVEEYDRTSQVVWNEYAGANWNYNTNITTETSKILLQKNMQIA
QHTLKYGTQARKFDVNQLQNTTIKRIIKKVQDLERAALPAQELEEYNKIL
LDMETTYSVATVCHPQGSCLQLEPDLTNVMATSRKYEDLLWAWEGWRDKA
GRAILQFYPKYVELINQAARLNGYVDAGDSWRSMYETPSLEQDLERLFQE
LQPLYLNLHAYVRRALHRHYGAQHINLEGPIPAHLLGNMWAQTWSNIYDL
VVPFPSAPSMDTTEAMLKQGWTPRRMFKEADDFFTSLGLLPVPPEFWQKS
MLEKPTDGREVVCHASAWDFYNGKDFRIKQCTTVNLEDLVVAHHEMGHIQ
YFMQYKDLPVALREGANPGFHEAIGDVLALSVSTPKHLHSLNLLSSEGGS
DEHDINFLMKMALDKIAFIPFSYLVDQWRWRVFDGSITKENYNQEWWSLR
LKYQGLCPPVPRTQGDFDPGAKFHIPSSVPYIRYFVSFIIQFQFHEALCQ
AAGHTGPLHKCDIYQSKEAGQRLATAMKLGFSRPWPEAMQLITGQPQMSA
SAMLSYFKPLLDWLRTENELHGEKLGWPQYNWTPNS
3D structure
PDB6h5w Molecular Basis for Multiple Omapatrilat Binding Sites within the ACE C-Domain: Implications for Drug Design.
ChainA
Resolution1.37 Å
3D
structure
Catalytic site residues are labeled in the structure
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Enzymatic activity
Catalytic site (original residue number in PDB) H353 A354 H383 E384 H387 E411 H513 Y523
Catalytic site (residue number reindexed from 1) H314 A315 H344 E345 H348 E372 H474 Y484
Enzyme Commision number 3.4.15.1: peptidyl-dipeptidase A.
Interaction with ligand
Site
#		 Ligand Ligand
chain		 Binding residues on receptor
(original residue number in PDB)		 Binding residues on receptor
(residue number reindexed from 1)		 Binding affinity
BS01 FUC A S45 E49 S6 E10
BS02 ZN A H383 H387 E411 H344 H348 E372
BS03 FT8 A Q281 H353 A354 S355 E384 H387 F457 K511 H513 Y520 Y523 Q242 H314 A315 S316 E345 H348 F418 K472 H474 Y481 Y484 PDBbind-CN: -logKd/Ki=10.80,Ki=0.016nM
BindingDB: Ki=0.015000nM,IC50=0.100000nM
BS04 FT8 A D121 E123 R124 W220 M223 E403 R522 D82 E84 R85 W181 M184 E364 R483 PDBbind-CN: -logKd/Ki=10.80,Ki=0.016nM
BindingDB: Ki=0.015000nM,IC50=0.100000nM
BS05 FT8 A N85 E123 V518 N46 E84 V479 PDBbind-CN: -logKd/Ki=10.80,Ki=0.016nM
BindingDB: Ki=0.015000nM,IC50=0.100000nM
Gene Ontology
Molecular Function
GO:0008237 metallopeptidase activity
GO:0008241 peptidyl-dipeptidase activity
Biological Process
GO:0006508 proteolysis
Cellular Component
GO:0016020 membrane

View graph for
Molecular Function
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Biological Process
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Cellular Component
External links
PDB RCSB:6h5w, PDBe:6h5w, PDBj:6h5w
PDBsum6h5w
PubMed30372620
UniProtP12821|ACE_HUMAN Angiotensin-converting enzyme (Gene Name=ACE)

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