2025-03-29_00000399
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ligand
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9HHC
Crystal Structure of the Plasmodium falciparum Bromodomain PfBDP1 in complex with MPM2;
X-ray diffraction 1.56Å
Protein #1
137 residues (94% resolved)
Raw Sequence ...
GPLGSPEFMNKQWYLLANQLILSLSKYEGGHIFEKLVDAKKQNCPDYYDVIKNPMSFSCIKTKLKKGQYAYPSEFVKDVQLIFDNCSLYNTSNSVVAITGKNIETYFNNQLIVMGYNNFILKEKKINDMLKLVEEEN
Canonical Sequence ...
GPLGSPEFMNKQWYLLANQLILSLSKYEGGHIFEKLVDAKKQNCPDYYDVIKNPMSFSCIKTKLKKGQYAYPSEFVKDVQLIFDNCSLYNTSNSVVAITGKNIETYFNNQLIVMGYNNFILKEKKINDMLKLVEEEN
Non polymer #2
BU3
InChI=1S/C4H10O2/c1-3(5)4(2)6/h3-6H,1-2H3/t3-,4-/m1/s1
InChI=1S/C4H10O2/c1-3(5)4(2)6/h3-6H,1-2H3/t3-,4-/m1/s1
SMILES: C[C@H]([C@@H](C)O)O
C[C@H]([C@@H](C)O)O
Non polymer #3
I5K
InChI=1S/C16H18N2O/c1-10-15-13(7-2-3-8-14(15)19)16(18-10)11-5-4-6-12(17)9-11/h4-6,9,18H,2-3,7-8,17H2,1H3
InChI=1S/C16H18N2O/c1-10-15-13(7-2-3-8-14(15)19)16(18-10)11-5-4-6-12(17)9-11/h4-6,9,18H,2-3,7-8,17H2,1H3
SMILES: Cc1c2c(c([nH]1)c3cccc(c3)N)CCCCC2=O
Cc1c2c(c([nH]1)c3cccc(c3)N)CCCCC2=O
Biounit #1
monomer
Download coordinates
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Model
Reference
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