Structure of PDB 1lml Chain A Binding Site BS01

Receptor Information
>1lml Chain A (length=465) Species: 5664 (Leishmania major) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
VVRDVNWGALRIAVSTEDLTDPAYHCARVGQHVKDHAGAIVTCTAEDILT
NEKRDILVKHLIPQAVQLHTERLKVQQVQGKWKVTDMVGDICGDFKVPQA
HITEGFSNTDFVMYVASVPSEEGVLAWATTCQTFSDGHPAVGVINIPAAN
IASRYDQLVTRVVTHEMAHALGFSGPFFEDARIVANVPNVRGKNFDVPVI
NSSTAVAKAREQYGCDTLEYLEVEDQGGAGSAGSHIKMRNAQDELMAPAA
AAGYYTALTMAIFQDLGFYQADFSKAEVMPWGQNAGCAFLTNKCMEQSVT
QWPAMFCNAIRCPTSRLSLGACGVTRHPGLPPYWQYFTDPSLAGVSAFMD
YCPVVVPYSDGSCTQRASEAHASLLPFNVFSDAARCIDGAFRPKASYAGL
CANVQCDTATRTYSVQVHGSNDYTNCTPGLRVELSTVSNAFEGGGYITCP
PYVEVCQGNVQAAKD
Ligand information
Ligand IDZN
InChIInChI=1S/Zn/q+2
InChIKeyPTFCDOFLOPIGGS-UHFFFAOYSA-N
SMILES
SoftwareSMILES
CACTVS 3.341[Zn++]
ACDLabs 10.04
OpenEye OEToolkits 1.5.0		[Zn+2]
FormulaZn
NameZINC ION
ChEMBLCHEMBL1236970
DrugBankDB14532
ZINC
PDB chain1lml Chain A Residue 578 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB1lml The crystal structure of the Leishmania major surface proteinase leishmanolysin (gp63).
Resolution1.86 Å
Binding residue
(original residue number in PDB)		H264 H268 H334
Binding residue
(residue number reindexed from 1)		H165 H169 H235
Annotation score4
Enzymatic activity
Catalytic site (original residue number in PDB) H264 E265 H268 H334
Catalytic site (residue number reindexed from 1) H165 E166 H169 H235
Enzyme Commision number 3.4.24.36: leishmanolysin.
Gene Ontology
Molecular Function
GO:0004222 metalloendopeptidase activity
Biological Process
GO:0006508 proteolysis
GO:0007155 cell adhesion
Cellular Component
GO:0016020 membrane

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Molecular Function
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Biological Process
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Cellular Component
External links
PDB RCSB:1lml, PDBe:1lml, PDBj:1lml
PDBsum1lml
PubMed9739094
UniProtP08148|GP63_LEIMA Leishmanolysin (Gene Name=gp63)

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