Structure of PDB 3bmo Chain A

Receptor sequence
>3bmoA (length=255) Species: 5702 (Trypanosoma brucei brucei) [Search protein sequence]
EAPAAVVTGAAKRIGRAIAVKLHQTGYRVVIHYHNSAEAAVSLADELNKE
RSNTAVVCQADLTNSNVLPASCEEIINSCFRAFGRCDVLVNNASAFYPTP
LVQGKTVETQVAELIGTNAIAPFLLTMSFAQRQKGTTSSNLSIVNLCDAM
VDQPCMAFSLYNMGKHALVGLTQSAALELAPYGIRVNGVAPGVSLLPVAM
GEEEKDKWRRKVPLGRREASAEQIADAVIFLVSGSAQYITGSIIKVDGGL
SLVHA
3D structure
PDB3bmo Structure-based design of pteridine reductase inhibitors targeting african sleeping sickness and the leishmaniases.
ChainA
Resolution1.6 Å
3D
structure
Catalytic site residues are labeled in the structure
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Enzymatic activity
Catalytic site (original residue number in PDB) R14 D161 Y174 K178
Catalytic site (residue number reindexed from 1) R13 D148 Y161 K165
Enzyme Commision number ?
Interaction with ligand
Site
#		 Ligand Ligand
chain		 Binding residues on receptor
(original residue number in PDB)		 Binding residues on receptor
(residue number reindexed from 1)		 Binding affinity
BS01 NAP A R14 I15 Y34 H35 N36 S37 D62 L63 N93 A94 S95 T126 L159 K178 P204 G205 V206 S207 R13 I14 Y33 H34 N35 S36 D61 L62 N92 A93 S94 T117 L146 K165 P191 G192 V193 S194
BS02 AX4 A S95 F97 Y174 L209 P210 W221 S94 F96 Y161 L196 P197 W208 MOAD: Ki=5.4uM
PDBbind-CN: -logKd/Ki=5.27,Ki=5.4uM
Gene Ontology
Molecular Function
GO:0000166 nucleotide binding
GO:0016491 oxidoreductase activity
GO:0047040 pteridine reductase activity

View graph for
Molecular Function
External links
PDB RCSB:3bmo, PDBe:3bmo, PDBj:3bmo
PDBsum3bmo
PubMed19916554
UniProtO76290

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