Structure of PDB 5mqm Chain A Binding Site BS01

Receptor Information
>5mqm Chain A (length=1038) Species: 818 (Bacteroides thetaiotaomicron) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
LLREQFQNPSDEAKPWTFWYWMFGAVSKEGITADLEAMKRAGLGGTYLMP
IKGIKEGPQYNGKAQQLTPEWWEMVRFSMEEADRLGLKLGMHICDGFALA
GGPWMTPKESMQKIVWSDTIVDGGKIKGLHLPQPEAYEGFYEDISLFALP
VKEEAADVMPAQITCANIATGNHIDIKKTVNMDDAGVIRSSYPCYIQYEY
EQPFTCRNIEIILSGNNYQAHRLKVMASDDGVNYRLVKQLVPARQGWQNT
DENSTHAIPATTARYFRFYWTPEGSEPGSEDMDAAKWKPNLKIKELRLHR
EARLDQWEGKAGLVWRVASSTKKEEIGEQDCYALSQIINLTDPFTLTATL
PKGKWKLLRMGHTATGHTNATAGGGKGLECDKFNPKAVRKQFDNWFAQAF
VKTNPDVARRVLKYMHVDSWECGSQNWSDTFAAEFRKRRGYDLMPYLPLL
AGIPMESAERSEKILRDVRTTIGELVVDVFYQVLADCAKEYDCQFSAECV
APTMVSDGLLHYQKVDLPMGEFWLNSPTHDKPNDMLDAISGAHIYGKNII
QAEGFTEVRGTWNEHPGILKALLDRNYALGINRLFFHVYVHNPWLDRKPG
MTLDGIGLFFQRDQTWWNKGAKAFCEYITRCQSLLQYGHPVADIAVFTGE
EMPRRSILPERLVPSLPGIFGAERVESERIRLANEGQPLRVRPVGVTHSA
NMSDPEKWVNPLRGYAYDSFNKDALLRLAKAENGRMTLPGGASYKVLVLP
LPRPMNPDPAALSPEVKQKINELKEAGILIPSLPYKEDDFSSYGLERDLI
VPENIAWTHRQGEQGDIYFIANQLEETRTFTASMRIDGRKPECWNPVTGE
INADIPYEQKSHRTEITLTLAPNESVFIVYPATGLEATEYTVTFTANGKT
IQRQELFDWSKEEDEQIRYYSGTAVYKTTFRWKSKVKEDQQVYLNLGKVC
DLATVRVNGIDCGTIWTAPYRADITAALKKGVNELEIEVTNTWANALKGA
DEGKAPFDGIWTNAKYRRAENTLLPAGLLGPLNFDVAN
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 chain5mqm Chain A Residue 1201 [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]
PDB5mqm Complex pectin metabolism by gut bacteria reveals novel catalytic functions.
Resolution2.11 Å
Binding residue
(original residue number in PDB)		D458 S459 E538 E561 E593
Binding residue
(residue number reindexed from 1)		D418 S419 E498 E521 E553
Annotation score4
Enzymatic activity
Enzyme Commision number ?
External links