Structure of PDB 7p38 Chain B Binding Site BS01

Receptor Information
>7p38 Chain B (length=830) Species: 1598 (Limosilactobacillus reuteri) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
TVEAGPWENMAYSMDSNSINNIDGYISYTGWYRPYGTSQDGKTWYPTTVA
DWRPILMYVWPSKDVQAKFIQYFVNHGYENSNYGLTTGSVKDLSENTASI
KLNEVAQNLRYVIEQHIVAAKSTSQLANDINNFITTIPELSASSELPYGQ
VIFVNNDNTSYADSKYRLMSRTINNQTGNDNDNSDNGYEFLTGIDIDNSN
PVVQAENLNWEYFLLNYGKLMGYNPDGNFDGFRIDAADHIDADVLDQTGQ
LMDDMYHMKGNPQNANNHLSYNEGYRSSAARMLNKKGNPQLYMDYVGSTL
GNVLGRANNRDTISNLVTGSIVNRQNDVTENEATPNWSYVTNHDSRANLI
NGLISKDHPGAEYANQAWQEFYADQKKTDKQYAQYNVPAQYAILLSNKDT
VPQIYYGDLYNETAQYMQEKSIYYDAITTLMKARKQFVSGGQTMTKLSDN
LIASVRYGKGVTNANSEGTDSLSRTSGMAVIVGNNPQMAEQTISINMGRA
HANEQYRNLLDTTDNGLTYNADGAENPETLTTDDNGILKVTVKGYSNPYV
SGYLGVWVPVVSGNQDVTTNAATVSADSNKIFESNAALDSHMIYQDFSLY
QPEPTSTENHAYNTIAQNAELFNNLGITDFWMAPPYTQYSESRYNDGYSV
TDRYNLGTNANPTKYGSGEELANAIAALHSAGLKVQVDIVMNQMIGLPGQ
EAVTVTRADNRGIQTYVNGKTYANQMYFAYTTGGGNGQETYGGKYLSELQ
SKYPDLFTTRAISTGVAPDPTTRITKWSAKYENGTSLQNIGIGLAVKLPN
GEYAYLRSSDNKAFNTTLPETMSSADYYAN
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 chain7p38 Chain B Residue 1301 [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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PDB7p38 Insights into Broad-Specificity Starch Modification from the Crystal Structure of Limosilactobacillus Reuteri NCC 2613 4,6-alpha-Glucanotransferase GtfB.
Resolution2.7 Å
Binding residue
(original residue number in PDB)		E633 D639 H683 N1139
Binding residue
(residue number reindexed from 1)		E189 D195 H239 N692
Annotation score1
Enzymatic activity
Enzyme Commision number 2.4.1.5: dextransucrase.
Gene Ontology
Molecular Function
GO:0046527 glucosyltransferase activity
Biological Process
GO:0009250 glucan biosynthetic process

View graph for
Molecular Function
View graph for
Biological Process
External links
PDB RCSB:7p38, PDBe:7p38, PDBj:7p38
PDBsum7p38
PubMed34708648
UniProtA0A1Z2RUH3

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