Structure of PDB 7nsn Chain A Binding Site BS02

Receptor Information
>7nsn Chain A (length=1371) Species: 220687 (Neobacillus novalis) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
SKTDFFSSFEKSDLQLTWTNTVETDANGKKMSSGIDGNVKRDLILGDITD
KVVQVTASANNPPNEIDSKLIDGDPTTKWLAFEPTANIVLKLAEPVAVVK
YALTSANDAKGRDPKNWTLYGSLDGTNWTAVDTREGEDFKDRFQRNMYDL
KNTTKYLYYKLDITKNAGDSITQLAEISLSDGIEVPAPPPGDMKSLIGKG
PTSSYTAKTNVGWTGLGALNYSGTHLSDGRAYSYNKLYDVDILVTPATEL
SYFIAPEFTDKNHNDYSSTYVSVDLAFSDGTYLHDLKAVDQYGVGLNPKD
QGDSKYLYVNQWNTIKSTIGSVAAGKTIKRILVAYDNPKGPGAFRGSIDD
IKIDGKPVQKAFGSPIDYVNILRGTQSNGSFSRGNNFPAVAIPHGFNFWT
PTTNAGSSWIYQYHESNSVNNLPQIQAFSVSHEPSPWMGDRQTFQVMPSA
STAATPNANRDSRALEFNHANEIAQPHYYSVKFENGIRTEMTPTDHAAMF
KFTFTGATSNLIFDNVNNNGGLTIDAKSGEITGYSDVKSGLSTGATRLFV
YAAFDKPVIKSGKLTGESRNNVTGYVRFDTSKDEDKVVTMKIATSLISVE
QAKKNLEQEIGLNDTFEGLKEKAKTEWNKKLGIIEVEGASEDQLVTLYSN
LYRLFLYPNSAFENVGTTTDPVYKYASPYSAATGQDTATTTGAKIVDGKT
YVNNGFWDTYRTAWPAYSLLTPTFAGELIDGFVQQYRDGGWIARWSSPGF
ANLMPGTSSDVAFADAYLKGVTNFDVQSFYQSAIRNAEAVSPNAGTGRKG
LTTSIFDGYTNTSTGEGLAWAMDGYINDFGIANLAKALKEKGDKSDPYYA
NYAADYQYFLNRAQNYVHMFNPSIEFFNGRTANGAWRSTPDNFNPAVWGS
DYTETNGWNMAFHVPQDGQGLANLYGGKEGLATKLDQFFSTSETGLFPGS
YGGTIHEMREARDVRMGMYGHSNQPSHHIAYMYDYAGQPWKTQEKVREAL
NRLYIGSAIGQGYSGDEDNGEMSAWYILSAMGFYPLKMGTPEYAIGAPLF
KKATIHLENGKSIVINAPNNSKENKYVQSMKVNGKAYAKTSILHADIANG
AVIDFEMGSKPSKWGSGDQDILQSITPGSTDGTSLSPLPLRDVTDRLIAA
EKGAVTVSDEGNGQLLFDNTSNTQLSMKSKTPSIVYQFKEGKQNVKMYTL
TSSKASQNEDPKSWVLKGSNDGKSWSVLDQRKNETFQWRQYTRAFTIQHP
GKYSQYKLEITENAGAEVTTLAELELLGYDDVTNSYQAVYELMEQFKQSK
DLTGPMAVQLNNSLTTSLDHFKKDHKDQAIKHLEDFLKHLNNKGLQDRIS
SKAKGVLSADANQLIVLLARD
Ligand information
Ligand IDCA
InChIInChI=1S/Ca/q+2
InChIKeyBHPQYMZQTOCNFJ-UHFFFAOYSA-N
SMILES
SoftwareSMILES
CACTVS 3.341[Ca++]
ACDLabs 10.04
OpenEye OEToolkits 1.5.0		[Ca+2]
FormulaCa
NameCALCIUM ION
ChEMBL
DrugBankDB14577
ZINC
PDB chain7nsn Chain A Residue 1502 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
Global viewLocal viewStructure summary

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PDB7nsn Structural and functional characterization of multi-domain GH92 alpha-1,2-mannosidase from Neobacillus novalis
Resolution2.29 Å
Binding residue
(original residue number in PDB)		S48 E50 T254 G257 D389
Binding residue
(residue number reindexed from 1)		S8 E10 T214 G217 D349
Annotation score4
Enzymatic activity
Enzyme Commision number 3.2.1.-
Gene Ontology
Molecular Function
GO:0030246 carbohydrate binding
Biological Process
GO:0005975 carbohydrate metabolic process

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Molecular Function
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Biological Process
External links
PDB RCSB:7nsn, PDBe:7nsn, PDBj:7nsn
PDBsum7nsn
PubMed37071393
UniProtA0A7R9KAR8

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