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• K_b,int Intrinsic binding constants (calculated from FTSA and protonation data)
• K_d,int Intrinsic dissociation constants (calculated from FTSA and protonation data)
• K_d,obs Observed dissociation constants (from FTSA experiments data)

A

• All methods log₁₀(K_d,int) statistics All method experiments K_d,int table log₁₀ statistics
• All methods log₁₀(K_d,obs) statistics All method experiments K_d,obs table log₁₀ statistics

B

• Best buffer protonation Thermodynamic parameters of buffer protonation
• Best compound protonation pK_a Arithmetic averages of compound pK_a values that fulfill the defined threshold of reliability.
• Best compound protonation ΔH_a Arithmetic averages of compound ΔH_a values that fulfill the defined threshold of reliability.
• Best protein protonation pK_a Arithmetic averages of protein pK_a values that fulfill the defined threshold of reliability.
• Best protein protonation ΔH_a Arithmetic averages of protein ΔH_a values that fulfill the defined threshold of reliability.

• Buffers Buffer composition

C

• Compound batches Properties of synthesized chemical compound batches
• Compounds Compound (ligand) properties
• Crystal structures X-ray crystallographic structures of protein-ligand complexes

D

• Devices Instruments used for measurements

F

• Files Data files and documents
• FTSA experiments Fluorescent thermal shift assay (FTSA, TSA, DSF, ThermoFluor, TF) experimental data

I

• Intrinsic enthalpy statistics Intrinsic Gibbs energy and enthalpy statistics

• Intrinsic parameters The thermodynamic parameters of protein-ligand interaction, corrected to account for linked protonation reactions.
• ITC experiments Isothermal titration calorimetry (ITC) experimental data

P

• Protein batches Purified protein batches
• Proteins Protein properties and origins
• Publications The list contains publications used as PLBD data sources

R

• Relations experiment_itc-file ITC experiments and files relations
• Relations experiment_sfa-file SFA experiments and files relations
• Relations experiment_spr-file SPR experiments and files relations
• Relations experiment_tsa-file FTSA experiments and files relations
• Relations experiment_tsa-publication FTSA experiments and publications relations
• Revisions Data revisions of Protein-Ligand Binding Database

S

• SFA experiments Experimental data of stopped-flow assay (SFA) of enzyme inhibition

• SPR experiments Experimental data of surface plasmon resonance
• Structures-binding relations X-ray crystallographic structures and binding thermodynamics

T

• Table statistics Records number in key tables of the `BVTS` database

V

• Versions Versions of Protein-Ligand Binding Database schema

Δ

• ΔG_b,int The intrinsic Gibbs energy changes upon binding (calculated from FTSA and protonation data)
• ΔG_b,obs The observed Gibbs energy changes upon binding (from FTSA experiments)
• ΔH_b,int The intrinsic binding enthalpy changes (calculated from ITC and protonation data)