Table 5 Comparison of the fitted parameters by IDAP, TITAN, and NmrLineGuru for the E22A CsnN174 chitosanase titration data¹⁰. The input data for IDAP and NmrLineGuru are the six 1D spectral slices described in Fig. 7 while TITAN uses nine amide NH 2D peaks¹⁰ (residues N23, W28, A30, G39, G43, G47, G153, T157, and D232). The fitted values for IDAP and TITAN are from reference¹⁰. The fitted parameter values for NmrLineGuru are shown with 95% confidence intervals determined by Monte Carlo resampling. UB: not determined due to reaching the upper boundary (50000 s⁻¹).

From: NmrLineGuru: Standalone and User-Friendly GUIs for Fast 1D NMR Lineshape Simulation and Analysis of Multi-State Equilibrium Binding Models