Biophysical Society 60th Annual Meeting

Protein-Small Molecule Interactions II (Boards B41 - B70) 2664-Pos Board B41 INTERNATIONAL TRAVEL AWARDEE MODELING PROTEIN- DNA INTERACTION ON GROUNDS OF QUANTUM ENTANGLEMENT. Yadira Medina Guevara , Joao D. T. Arruda-Neto, Danyer Perez Adan 2665-Pos Board B42 ACCELERATED MOLECULAR DYNAMICS SIMULATIONS OF PHOSPHATE BINDING PROTEINS. Sigurd F. Truelsen 2666-Pos Board B43 INVESTIGATION OF INHIBITORY POTENCY OF BHQ DERIVATIVES AS SERCA INHIBITORS TO USE AS POTENTIAL DRUGS AS WELL AS TOOLS TO STUDY THE SERCA FUNCTION: BINDING FREE ENERGY COMPUTATION USING FEP/MD SIMULATIONS. Manori Jayasinghe , Qi Wang, Andrew Schirmer, George Stan 2667-Pos Board B44 INVESTIGATION OF HNO-DERIVED MODIFICATIONS ON PHOSPHOL- AMBAN. Gizem Keceli , Ananya Majumdar, Chevon N. Thorpe, James E. Mahaney, Nazareno Paolocci, John P. Toscano 2668-Pos Board B45 PHOSPHOLAMBAN INTERACTION WITH SR CA-ATPASE INVESTIGATED BY PRE-STEADY STATE CHARGE MEASUREMENTS. Serena Smeazzetto , Howard S. Young, Catharine A. Trieber, Maria Rosa Moncelli, Francesco Tadini-Buoninsegni 2669-Pos Board B46 MOLECULAR COMPETITORS OF THE ALPHA GLOBIN/ENOS INTERAC- TION. T. C. Stevenson Keller IV , Joshua T. Butcher, Brant E. Isakson, Linda M. Columbus 2670-Pos Board B47 CANCER CELL-DIRECTED DRUG DELIVERY AND CHEMOPOTENTIATING EFFECTS BY GSTP1-ACTIVATED NITRIC OXIDE (NO)-RELEASING PRO- DRUG. Vandana Kumari , Ryan J. Holland, Christina E. Luthers, Marzena A. Dyba, Sergey G. Tarasov, Joseph E. Saavedra, Larry K. Keefer, Xinhua Ji 2671-Pos Board B48 ISOTHERMAL ANALYSIS OF INTERACTION BETWEEN LIPOCALIN-TYPE PROSTAGLANDIN D SYNTHASE AND PROSTANOIDS. Yusuke Nakagawa , Shigeru Shimamoto, Yutaro Fukuda, Takahiro Maruno, Yuji Kobayashi, Tadayasu Ohkubo, Kousuke Aritake, Yoshihiro Urade, Yuji Hidaka 2672-Pos Board B49 FLUNITRAZEPAM CONVERSION BY CYP3A4 IS ALTERED BY CAFFEINE AND ETHANOL. Thomas R. Larson , Larry R. Masterson 2673-Pos Board B50 DECIPHERING THE BINDING MODE OF PROMISING ANTITUBERCULOSIS COMPOUNDS WITH THEIR BACTERIAL MEMBRANE TARGET IN LIVING CELLS BY NMR. Catherine Simenel, Guillaume Bouvier, Michael Nilges, Nadia Izadi Pruneyre 2674-Pos Board B51 A RAPID BIOCHEMICAL ASSAY TO MEASURE SMALL MOLECULES BIND- ING TO PREGNANE XENOBIOTIC RECEPTORS FROM HUMAN, DOG AND RAT. Anita Niedziela-Majka , Kristina Hinman, Johannes Voigt, Magdeleine Hung, Andrew Post, Roman Sakowicz 2675-Pos Board B52 CHARACTERIZATION OF THE MOLECULAR INTERACTIONS BETWEEN PARE/GYRB AND AN INHIBITOR AND ITS INSIGHT INTO DEVELOPING ANTIBACTERIAL AGENTS. Congbao Kang

2650-Pos Board B27 COMPUTATIONAL APPROACH TO DESIGNING ANTIBODY FOR EBOLA VIRUS. Amir Barati Farimani , Narayana R. Aluru, Emad Tajkhorshid, Eric

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Jakobsson 2651-Pos

Board B28 STRUCTURAL REFINEMENT OF BAR-PH DOMAINS REMODELING CELL MEMBRANE USING MDFF. Chun Chan, Xiaoyun Pang, Yan Zhang, Victor W. Hsu, Fei Sun, Jun Fan 2652-Pos Board B29 STRUCTURE AND INTERACTION OF TYPE II CAS1 FROM STERPTOCOCCUS PYOGENES. Donghyun Ka , Euiyoung Bae 2653-Pos Board B30 PROBING P53 ACTIVATING STAPLED-PEPTIDE INTERACTION WITH ALBU- MIN USING MOLECULAR DOCKING AND SIMULATION. Garima Tiwari , Chandra S. Verma 2654-Pos Board B31 COMPUTATIONAL AND EXPERIMENTAL STUDY OF NEUROGLOBIN AND CARBON MONOXIDE. Lauren Nelson , Samuel Cho, Daniel Kim-Shapiro 2655-Pos Board B32 ELUCIDATING THE ROLE OF STRUCTURAL DYNAMICS IN LIGAND SELEC- TION OF HUMAN ADIPOCYTE FATTY ACID BINDING PROTEIN BY NMR SPECTROSCOPY. Kim N. Ha , Youlin Xia, Yenchi Tran, Gianluigi Veglia, David Board B33 THE KNOB-SOCKET MODEL: AN AMINO ACID CODE DESCRIBING PROTEIN TERTIARY PACKING STRUCTURE. Hyun Joo, Keith J. Fraga, Jerry Tsai 2657-Pos Board B34 AN AMINO ACID CODE FOR THE RATIONAL DESIGN AND INVESTIGATION OF PROTEIN PACKING STRUCTURE USING THE KNOB-SOCKET MOD- EL. Shivarni Patel , Hyun Joo, Jerry Tsai 2658-Pos Board B35 AUTOMATED CROSS-LINKS-BASED CONFORMATIONAL SAMPLING OF PROTEIN ASSEMBLIES : THE GEOMETRICAL CHALLENGE OF CROSS- LINKS. Mathias Ferber , Michael Nilges, Guillaume Bouvier 2659-Pos Board B36 PHOTOCONTROL OF PROTEIN AFFINITY REAGENTS BY RED LIGHT USING AZOBENZENE SWITCHES. Amirhossein Babalhavaeji , Mingxin Dong, Di Wu, G. AndrewWoolley 2660-Pos Board B37 BLUE LIGHT CONTROL OF CREB VIA A DESIGNED DOMINANT NEGA- TIVE.  Jakeb M. Reis , Ahmed M. Ali, Yan Xia, Asim Rashid, Valentina Mercaldo, Katherine Brechun, Vitali Borisenko, Sheena Josselyn, John Karanicolas, AndrewWoolley 2661-Pos Board B38 VIBRATIONAL AND ELECTRONIC STARK EFFECTS IN GREEN FLUORESCENT PROTEIN.  Joshua D. Slocum , Lauren J. Webb 2662-Pos Board B39 A SPLIT GFP BARREL WITH AN INTERNAL CAVITY THAT BINDS THE CHRO- MOPHORE. Chi-Yun Lin , Steven G. Boxer 2663-Pos Board B40 A REVERSIBLY PHOTODISSOCIABLE SPLIT GFP.  Johan H. Both , Steven G. Boxer Bernlohr 2656-Pos

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