2026-05-09_00000108
|
ligand
|
9R3N
The structure of Aspergillus fumigatus phosphoglucose isomerase in complex with fragments;
X-ray diffraction 1.83Å
Protein #1
558 residues (100% resolved)
Raw Sequence ...
GPLGSMPGFSQATELGAWKELQEHHNSLGRNIVLKEYFEKDPQRFEKFSRTFANPVDNTEILFDFSKNFLTEETLALLVKLAREAGVEELRDAMFKGDPINFTEDRAVYHVALRNVTNEPMQVNGKSVVEDVNSVLEHMKEFTEQVRSGEWKGYTGKKITTIINIGIGGSDLGPVMVTEALKPYGAEDMTLHFVSNIDGSHIAEALKHSDPETTLFLIASKTFTTAETTTNANSAKKWFLESAKDEAHIAKHFVALSTNEEEVTKFGIDKKNMFGFASWVGGRYSVWSAIGLSVALYIGFDNFHQFLAGAHAMDKHFRETPLEQNIPVLGGLLSVWYSDFFGAQTHLVAPFDQYLHRFPAYLQQLSMESNGKAITRTGEYVKYTTGPILFGEPATNAQHSFFQLLHQGTKLIPSDFIMAAESHNPVEGGKHQRMLASNFLAQSEALMVGKTPEQVKTEGAPDNLVPHKTFLGNRPTTSILAQKITPSTLGALIAYYEHLTFTEGAVWNINSFDQWGVELGKVLAKKIQKELETPGAGGDHDASTSGLLLAFKKKANLA
Canonical Sequence ...
GPLGSMPGFSQATELGAWKELQEHHNSLGRNIVLKEYFEKDPQRFEKFSRTFANPVDNTEILFDFSKNFLTEETLALLVKLAREAGVEELRDAMFKGDPINFTEDRAVYHVALRNVTNEPMQVNGKSVVEDVNSVLEHMKEFTEQVRSGEWKGYTGKKITTIINIGIGGSDLGPVMVTEALKPYGAEDMTLHFVSNIDGSHIAEALKHSDPETTLFLIASKTFTTAETTTNANSAKKWFLESAKDEAHIAKHFVALSTNEEEVTKFGIDKKNMFGFASWVGGRYSVWSAIGLSVALYIGFDNFHQFLAGAHAMDKHFRETPLEQNIPVLGGLLSVWYSDFFGAQTHLVAPFDQYLHRFPAYLQQLSMESNGKAITRTGEYVKYTTGPILFGEPATNAQHSFFQLLHQGTKLIPSDFIMAAESHNPVEGGKHQRMLASNFLAQSEALMVGKTPEQVKTEGAPDNLVPHKTFLGNRPTTSILAQKITPSTLGALIAYYEHLTFTEGAVWNINSFDQWGVELGKVLAKKIQKELETPGAGGDHDASTSGLLLAFKKKANLA
Non polymer #2
CL
InChI=1S/ClH/h1H/p-1
InChI=1S/ClH/h1H/p-1
SMILES: [Cl-]
[Cl-]
Non polymer #3
NA
InChI=1S/Na/q+1
InChI=1S/Na/q+1
SMILES: [Na+]
[Na+]
Non polymer #4
PA5
InChI=1S/C5H11O9P/c6-2(1-14-15(11,12)13)3(7)4(8)5(9)10/h2-4,6-8H,1H2,(H,9,10)(H2,11,12,13)/t2-,3-,4+/m1/s1
InChI=1S/C5H11O9P/c6-2(1-14-15(11,12)13)3(7)4(8)5(9)10/h2-4,6-8H,1H2,(H,9,10)(H2,11,12,13)/t2-,3-,4+/m1/s1
SMILES: C([C@H]([C@H]([C@@H](C(=O)O)O)O)O)OP(=O)(O)O
C([C@H]([C@H]([C@@H](C(=O)O)O)O)O)OP(=O)(O)O
Non polymer #5
XKD
InChI=1S/C4H10N2O/c1-3(5)4(7)6-2/h3H,5H2,1-2H3,(H,6,7)/t3-/m1/s1
InChI=1S/C4H10N2O/c1-3(5)4(7)6-2/h3H,5H2,1-2H3,(H,6,7)/t3-/m1/s1
SMILES: C[C@H](C(=O)NC)N
C[C@H](C(=O)NC)N
Biounit #1
homo-dimer
Download coordinates
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Model
Reference
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