Binding of beta-lactam antibiotics by equine, caprine and ovine serum albumins
Sekula, B., Duszynski, K., Talaj, J., Bujacz, A.To be published.
Experimental Data Snapshot
Starting Model: experimental
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Entity ID: 1 | |||||
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Molecule | Chains | Sequence Length | Organism | Details | Image |
Albumin | 580 | Equus caballus | Mutation(s): 0  | ||
UniProt | |||||
Find proteins for P35747 (Equus caballus) Explore P35747  Go to UniProtKB:  P35747 | |||||
Entity Groups   | |||||
Sequence Clusters | 30% Identity50% Identity70% Identity90% Identity95% Identity100% Identity | ||||
UniProt Group | P35747 | ||||
Sequence AnnotationsExpand | |||||
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Ligands 5 Unique | |||||
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ID | Chains | Name / Formula / InChI Key | 2D Diagram | 3D Interactions | |
8XI (Subject of Investigation/LOI) Query on 8XI | B [auth A], C [auth A] | Cefaclor C15 H14 Cl N3 O4 S QYIYFLOTGYLRGG-GPCCPHFNSA-N | |||
LMR Query on LMR | I [auth A] | (2S)-2-hydroxybutanedioic acid C4 H6 O5 BJEPYKJPYRNKOW-REOHCLBHSA-N | |||
MLI Query on MLI | D [auth A], E [auth A], F [auth A], G [auth A], H [auth A] | MALONATE ION C3 H2 O4 OFOBLEOULBTSOW-UHFFFAOYSA-L | |||
ACT Query on ACT | Q [auth A], R [auth A] | ACETATE ION C2 H3 O2 QTBSBXVTEAMEQO-UHFFFAOYSA-M | |||
FMT Query on FMT | J [auth A] K [auth A] L [auth A] M [auth A] N [auth A] | FORMIC ACID C H2 O2 BDAGIHXWWSANSR-UHFFFAOYSA-N |
Length ( Å ) | Angle ( ˚ ) |
---|---|
a = 94.75 | α = 90 |
b = 94.75 | β = 90 |
c = 142.62 | γ = 120 |
Software Name | Purpose |
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REFMAC | refinement |
PDB_EXTRACT | data extraction |
XDS | data reduction |
Coot | model building |
XDS | data scaling |
MOLREP | phasing |
Funding Organization | Location | Grant Number |
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Polish National Science Centre | Poland | 2013/11/B/ST5/02271 |