Kras-G12D-GDP-MRTX1133 by FIB-MicroED
Li, X.M.To be published.
Experimental Data Snapshot
Starting Model: experimental
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wwPDB Validation   3D Report Full Report
Entity ID: 1 | |||||
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Molecule | Chains | Sequence Length | Organism | Details | Image |
KRAS proto-oncogene, GTPase | 169 | Homo sapiens | Mutation(s): 2  Gene Names: mMyoMyo1_007468 | ![]() | |
UniProt | |||||
Find proteins for A0A7J7Z4L6 (Myotis myotis) Explore A0A7J7Z4L6  Go to UniProtKB:  A0A7J7Z4L6 | |||||
Entity Groups   | |||||
Sequence Clusters | 30% Identity50% Identity70% Identity90% Identity95% Identity100% Identity | ||||
UniProt Group | A0A7J7Z4L6 | ||||
Sequence AnnotationsExpand | |||||
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Ligands 3 Unique | |||||
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ID | Chains | Name / Formula / InChI Key | 2D Diagram | 3D Interactions | |
6IC (Subject of Investigation/LOI) Query on 6IC | C [auth A] | 4-(4-[(1R,5S)-3,8-diazabicyclo[3.2.1]octan-3-yl]-8-fluoro-2-{[(2R,4R,7aS)-2-fluorotetrahydro-1H-pyrrolizin-7a(5H)-yl]methoxy}pyrido[4,3-d]pyrimidin-7-yl)-5-ethynyl-6-fluoronaphthalen-2-ol C33 H31 F3 N6 O2 SCLLZBIBSFTLIN-INOGPEIASA-N | |||
GDP (Subject of Investigation/LOI) Query on GDP | B [auth A] | GUANOSINE-5'-DIPHOSPHATE C10 H15 N5 O11 P2 QGWNDRXFNXRZMB-UUOKFMHZSA-N | |||
MG (Subject of Investigation/LOI) Query on MG | D [auth A] | MAGNESIUM ION Mg JLVVSXFLKOJNIY-UHFFFAOYSA-N |
Length ( Å ) | Angle ( ˚ ) |
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a = 38.88 | α = 90 |
b = 49.28 | β = 90 |
c = 87.2 | γ = 90 |
Software Name | Purpose |
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PHENIX | refinement |
Task | Software Package | Version |
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MODEL REFINEMENT | PHENIX | 1.19.2 |
Funding Organization | Location | Grant Number |
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Not funded | China | -- |