NMR dataset for metallo-B-lactamase IMP-1

<p>NMR dataset to support publication: Localising individual atoms of tryptophan side chains in the metallo-B-lactamase IMP-1 by pseudocontact shifts from paramagnetic lanthanoid tags at multiple sites</p> <p>NMR data are in Bruker format and pulse programs are contained within each dataset with the name &quot;pulprog&quot;</p> <p>Table of contents</p> <p>Experiment number&nbsp;&nbsp; &nbsp;Experiment</p> <p>1&nbsp;&nbsp; &nbsp;&nbsp;&nbsp; &nbsp;&nbsp;&nbsp; &nbsp;IMP1 A53C with C2-Y tag (figure S3-a)<br> 2&nbsp;&nbsp;&nbsp;&nbsp;&nbsp;&nbsp;&nbsp;&nbsp;&nbsp;&nbsp;&nbsp; IMP1 A53C with C2-Tb tag (figure S3-a)<br> 3&nbsp;&nbsp; &nbsp;&nbsp;&nbsp; &nbsp;&nbsp;&nbsp; &nbsp;IMP1 A53C with C2-Tm tag (figure S3-a)<br> 4&nbsp;&nbsp; &nbsp;&nbsp;&nbsp; &nbsp;&nbsp;&nbsp; &nbsp;captopril bound IMP1 A53C with C2-Y tag (figure S4-a)<br> 5&nbsp;&nbsp; &nbsp;&nbsp;&nbsp; &nbsp;&nbsp;&nbsp; &nbsp;captopril bound IMP1 A53C with C2-Tb tag (figure S4-a)<br> 6&nbsp;&nbsp; &nbsp;&nbsp;&nbsp; &nbsp;&nbsp;&nbsp; &nbsp;captopril bound IMP1 A53C with C2-Tm tag (figure S4-a)<br> 7&nbsp;&nbsp; &nbsp;&nbsp;&nbsp; &nbsp;&nbsp;&nbsp; &nbsp;IMP1 N172C with C2-Y tag (figure S3-b)<br> 8&nbsp;&nbsp; &nbsp;&nbsp;&nbsp; &nbsp;&nbsp;&nbsp; &nbsp;IMP1 N172C with C2-Tb tag (figure S3-b)<br> 9&nbsp;&nbsp; &nbsp;&nbsp;&nbsp; &nbsp;&nbsp;&nbsp; &nbsp;IMP1 N172C with C2-Tm tag (figure S3-b)<br> 10&nbsp;&nbsp; &nbsp;&nbsp;&nbsp; &nbsp;&nbsp;&nbsp; &nbsp;captopril bound IMP1 N172C with C2-Y tag (figure S4-b)<br> 11&nbsp;&nbsp; &nbsp;&nbsp;&nbsp; &nbsp;&nbsp;&nbsp; &nbsp;captopril bound IMP1 N172C with C2-Tb tag (figure S4-b)<br> 12&nbsp;&nbsp; &nbsp;&nbsp;&nbsp; &nbsp;&nbsp;&nbsp; &nbsp;captopril bound IMP1 N172C with C2-Tm tag (figure S4-b)<br> 13&nbsp;&nbsp; &nbsp;&nbsp;&nbsp; &nbsp;&nbsp;&nbsp; &nbsp;IMP1 S204C with C2-Y tag (figure S3-c)<br> 14&nbsp;&nbsp; &nbsp;&nbsp;&nbsp; &nbsp;&nbsp;&nbsp; &nbsp;IMP1 S204C with C2-Tb tag (figure S3-c)<br> 15&nbsp;&nbsp; &nbsp;&nbsp;&nbsp; &nbsp;&nbsp;&nbsp; &nbsp;IMP1 S204C with C2-Tm tag (figure S3-c)&nbsp;&nbsp; &nbsp;<br> 16&nbsp;&nbsp; &nbsp;&nbsp;&nbsp; &nbsp;&nbsp;&nbsp; &nbsp;captopril bound IMP1 S204C with C2-Y tag (figure S4-c)<br> 17&nbsp;&nbsp; &nbsp;&nbsp;&nbsp; &nbsp;&nbsp;&nbsp; &nbsp;captopril bound IMP1 S204C with C2-Tb tag (figure S4-c)<br> 18&nbsp;&nbsp; &nbsp;&nbsp;&nbsp; &nbsp;&nbsp;&nbsp; &nbsp;captopril bound IMP1 S204C with C2-Tm tag (figure S4-c)<br> 19&nbsp;&nbsp; &nbsp;&nbsp;&nbsp; &nbsp;&nbsp;&nbsp; &nbsp;IMP1 N172C with C2-Y tag (figure 2-B)<br> 20&nbsp;&nbsp; &nbsp;&nbsp;&nbsp; &nbsp;&nbsp;&nbsp; &nbsp;IMP1 N172C with C2-Tb tag (figure 2-E)<br> 21&nbsp;&nbsp; &nbsp;&nbsp;&nbsp; &nbsp;&nbsp;&nbsp; &nbsp;IMP1 S204C with C2-Y tag (figure 2-F)&nbsp;&nbsp; &nbsp;<br> 22&nbsp;&nbsp; &nbsp;&nbsp;&nbsp; &nbsp;&nbsp;&nbsp; &nbsp;IMP1 N172C with C2-Y tag (figure 2-E)<br> 23&nbsp;&nbsp; &nbsp;&nbsp;&nbsp; &nbsp;&nbsp;&nbsp; &nbsp;IMP1 N172C with C12-Y tag (figure S5-a)<br> 24&nbsp;&nbsp; &nbsp;&nbsp;&nbsp; &nbsp;&nbsp;&nbsp; &nbsp;IMP1 N172C with C12-Tb tag (figure S5-a)<br> 25&nbsp;&nbsp; &nbsp;&nbsp;&nbsp; &nbsp;&nbsp;&nbsp; &nbsp;IMP1 N172C with C12-Tm tag (figure S5-a)<br> 26&nbsp;&nbsp; &nbsp;&nbsp;&nbsp; &nbsp;&nbsp;&nbsp; &nbsp;captopril bound IMP1 N172C with C12-Y tag (figure S5-b)<br> 27&nbsp;&nbsp; &nbsp;&nbsp;&nbsp; &nbsp;&nbsp;&nbsp; &nbsp;captopril bound IMP1 N172C with C12-Tb tag (figure S5-b)<br> 28&nbsp;&nbsp; &nbsp;&nbsp;&nbsp; &nbsp;&nbsp;&nbsp; &nbsp;captopril bound IMP1 N172C with C12-Tm tag (figure S5-b)</p>