Structure of PDB 7bvc Chain A Binding Site BS02

Receptor Information
>7bvc Chain A (length=1078) Species: 246196 (Mycolicibacterium smegmatis MC2 155) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
EPSRIARLIAVVAGIAGVLLCGLVPLLPVEETTATVLWPQGVGADGNVTE
LTAPLVAGAPRALDVTIPCRAVAELPADGGVVFSTNPAGGIEAGRNGMFI
RANADVVYVAFRDTVAAVAPREAVDSGACSEIHVWADVSAVGADFAGIPD
ASGTLPVDKRPQVSGVFTDLKVPAQPGLAARIDIDTRFITSPTLLKTAVM
VLGLACVIGSIVALALLDRGWRRRPPRTRGRAGLWTWITDTGVIGGLLIW
HIVGAPTSDDGYNMTIARVASEAGYTTNYYRYFGASEAPFDWYQSVLSHL
ASISTAGVWMRLPATAAAIATWLIISRCVLPRIGRRVAANRVAMLTAGAT
FLAAWLPFNNGLRPEPLIAFAVITVWMLVENSIGTRRLWPAAVAIVIAMF
SVTLAPQGLIALAPLLVGARAIGRVVTARRAGTGILASLAPLAASVAVVF
VIIFRDQTLATVAESVRIKYVVGPTIPWYQEFLRYYFLTVEDSVDGSLTR
RFAVLVLLLCLFGLIMVLLRRGRVPGAVSGPLWRLCGSTAIGLLLLILTP
TKWAIQFGAFAGLAGALGGVTAFAFARVGLHSRRNLALYVTALLFILAWA
TSGLNGWFYVGNYGVPWFDKQPVIAHYPVTTIFLVLAIVGGLLAGWLHFR
MDYAGHTEVADTGRNRALASTPLLIVATIMVVLELGSMVKATVGRYPVYT
VGSANIAALRSAGDSCAMADAVLVEADPNEGMLQPVPGQRFGEYGPLGGE
DPVGFTPNGVSDTLEPAEPVAANPGTPNSDGPVDKPNIGIGYAAGTGGGY
GPEGVNGSRVFLPFGLDPSRTPVMGSYGENKLAAKATSAWYQLPPRTPDR
PLVTVAAAGAIWYYEEDGSFNYGQSLKLQWGVHRPDGTYQALSEVQPIDI
FQQKAWRNLRFPLAWAPPEANVARIVADDPNLSEDQWFAFTPPRVPVLQT
AQQFLGSQTPVLMDIATAANFPCQRPFAERLGVAELPEYRIIPNFKQMVV
SSNQWQSAADGGPFLFIQALLRTEAIPTYLRDDWYRDWGSIERYIRVVPQ
EQAPTAAIEEGSTRVFGWSRGGPIRALP
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 chain7bvc Chain A Residue 1103 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
Global viewLocal viewStructure summary

[Spin on] [Spin off] [Reset]
[High quality] [Low quality]
[White background] [Black background]
[Spin on] [Spin off] [Reset]
[High quality] [Low quality]
[White background] [Black background]
PDB7bvc Structures of cell wall arabinosyltransferases with the anti-tuberculosis drug ethambutol.
Resolution2.9 Å
Binding residue
(original residue number in PDB)		D931 N933 Q938
Binding residue
(residue number reindexed from 1)		D929 N931 Q936
Annotation score4
Enzymatic activity
Enzyme Commision number 2.4.2.-
Gene Ontology
Molecular Function
GO:0016757 glycosyltransferase activity
GO:0052636 arabinosyltransferase activity
Biological Process
GO:0071555 cell wall organization
GO:0071766 Actinobacterium-type cell wall biogenesis
Cellular Component
GO:0005886 plasma membrane

View graph for
Molecular Function
View graph for
Biological Process
View graph for
Cellular Component
External links
PDB RCSB:7bvc, PDBe:7bvc, PDBj:7bvc
PDBsum7bvc
PubMed32327601
UniProtA0R613

[Back to BioLiP]