Analysis of pair 1qb3A_3qy2A

1qb3A vs 3qy2A

Figure 1: Two structures (Fold1 & Fold2)

Figure 2: Two structures aligned

Missing: Fold1 vs best AF2
Missing: Fold2 vs best AF2
Missing: Fold1 vs best AF3
Missing: Fold2 vs best AF3
Missing: Fold1 vs best ESM2
Missing: Fold2 vs best ESM2
Missing: Fold1 vs best ESM3
Missing: Fold2 vs best ESM3
[missing] 1qb3A vs. 3qy2A (unaligned) — interactive
[missing] 1qb3A vs. 3qy2A (aligned) — interactive

Figure 3: Deep-MSA contact map panel

Figure 4: Best clusters contact map panel

Figure 5: All clusters contact-map mosaic (small multiples).

Per-cluster contact maps

Figure 6: Aligned per-residue ΔΔG (seq alignment overlay).

Figure 7: Phylogenetic tree with per-cluster heatmap.

Cluster metrics table

clusternneffAF2_TM1AF2_TM2AF3_TM1AF3_TM2RE-MSAT-COMRE-MSAT1RE-MSAT2ESM_SEQIDSESM_TM1_LISTESM_TM2_LIST
Deep--0.730.920.740.920.00.00.01---
000--0.450.60.450.60.020.020.02005; 001; 005; 002; 001; 002; 009; 009; 003; 0030.46; 0.43; 0.43; 0.43; 0.43; 0.42; 0.37; 0.37; 0.33; 0.330.59; 0.57; 0.57; 0.53; 0.57; 0.52; 0.48; 0.48; 0.35; 0.34
001--0.430.580.430.580.00.00.0001; 001; 008; 008; 004; 004; 005; 005; 002; 0020.44; 0.44; 0.42; 0.42; 0.36; 0.36; 0.33; 0.33; 0.31; 0.280.58; 0.57; 0.53; 0.52; 0.45; 0.44; 0.34; 0.35; 0.41; 0.39
002--0.420.580.420.570.00.00.0004; 004; 005; 005; 001; 001; 006; 006; 009; 0090.56; 0.56; 0.51; 0.51; 0.45; 0.45; 0.44; 0.43; 0.37; 0.370.70; 0.70; 0.65; 0.65; 0.59; 0.59; 0.58; 0.57; 0.41; 0.41
003--0.730.920.740.920.00.00.0001; 001; 006; 006; 010; 010; 002; 002; 007; 0070.70; 0.70; 0.65; 0.65; 0.57; 0.57; 0.52; 0.51; 0.51; 0.500.87; 0.87; 0.80; 0.80; 0.71; 0.72; 0.65; 0.64; 0.65; 0.64
004--0.520.670.510.660.020.020.01010; 010; 005; 005; 009; 009; 001; 001; 003; 0030.51; 0.50; 0.46; 0.46; 0.42; 0.42; 0.42; 0.42; 0.36; 0.360.66; 0.65; 0.60; 0.60; 0.52; 0.51; 0.56; 0.56; 0.49; 0.49
005--0.690.860.690.860.00.00.0002; 002; 009; 001; 009; 001; 003; 003; 006; 0040.52; 0.51; 0.42; 0.41; 0.40; 0.40; 0.34; 0.34; 0.28; 0.280.67; 0.65; 0.58; 0.55; 0.55; 0.55; 0.35; 0.35; 0.29; 0.29
006--0.460.610.460.60.020.020.02006; 006; 005; 005; 007; 007; 004; 004; 001; 0020.49; 0.49; 0.47; 0.47; 0.42; 0.41; 0.37; 0.37; 0.35; 0.350.65; 0.65; 0.58; 0.57; 0.56; 0.55; 0.50; 0.50; 0.48; 0.47
007--0.510.660.50.650.00.00.0006; 006; 002; 002; 009; 009; 007; 001; 001; 0070.45; 0.45; 0.41; 0.41; 0.37; 0.37; 0.37; 0.36; 0.36; 0.350.60; 0.59; 0.53; 0.53; 0.48; 0.48; 0.39; 0.49; 0.48; 0.38
008--0.450.590.440.590.00.00.0010; 003; 003; 002; 002; 001; 007; 001; 007; 0100.43; 0.43; 0.43; 0.43; 0.43; 0.42; 0.42; 0.42; 0.42; 0.420.54; 0.58; 0.58; 0.57; 0.57; 0.57; 0.55; 0.57; 0.55; 0.53
009--0.450.60.450.60.00.00.0001; 008; 008; 001; 002; 002; 003; 003; 009; 0090.43; 0.43; 0.43; 0.43; 0.33; 0.33; 0.33; 0.33; 0.31; 0.310.57; 0.57; 0.57; 0.57; 0.43; 0.43; 0.45; 0.45; 0.42; 0.42
010--0.610.770.610.770.00.00.0001; 001; 008; 008; 010; 010; 009; 009; 003; 0030.56; 0.56; 0.55; 0.55; 0.49; 0.49; 0.48; 0.48; 0.45; 0.450.71; 0.71; 0.70; 0.70; 0.63; 0.62; 0.63; 0.63; 0.58; 0.57
011--0.50.640.490.650.00.00.0002; 002; 005; 005; 001; 001; 003; 003; 004; 0040.45; 0.45; 0.42; 0.42; 0.41; 0.41; 0.38; 0.38; 0.37; 0.360.59; 0.59; 0.54; 0.54; 0.53; 0.53; 0.49; 0.49; 0.47; 0.46
012--0.460.610.470.630.030.030.03009; 001; 009; 010; 001; 002; 002; 010; 004; 0080.39; 0.36; 0.36; 0.36; 0.36; 0.34; 0.34; 0.34; 0.33; 0.310.49; 0.49; 0.46; 0.46; 0.51; 0.34; 0.34; 0.44; 0.34; 0.43
013--0.450.60.450.60.00.00.0002; 002; 001; 001; 005; 005; 006; 006; 004; 0030.48; 0.48; 0.43; 0.43; 0.42; 0.42; 0.39; 0.39; 0.36; 0.360.61; 0.60; 0.56; 0.56; 0.57; 0.57; 0.52; 0.52; 0.49; 0.49
014--0.550.710.50.640.00.00.0008; 008; 004; 004; 002; 003; 003; 002; 001; 0010.43; 0.42; 0.41; 0.41; 0.38; 0.38; 0.38; 0.38; 0.32; 0.320.54; 0.53; 0.54; 0.54; 0.53; 0.51; 0.51; 0.53; 0.43; 0.43
015--0.460.610.460.610.020.020.02006; 006; 007; 007; 001; 001; 003; 004; 004; 0030.51; 0.51; 0.46; 0.46; 0.44; 0.43; 0.42; 0.42; 0.42; 0.420.67; 0.67; 0.60; 0.60; 0.57; 0.57; 0.54; 0.52; 0.52; 0.54
016--0.460.60.450.60.00.00.0001; 001; 005; 005; 009; 009; 004; 003; 004; 0080.47; 0.47; 0.42; 0.42; 0.41; 0.41; 0.39; 0.38; 0.38; 0.360.60; 0.60; 0.54; 0.54; 0.55; 0.55; 0.53; 0.49; 0.52; 0.50
017--0.510.660.50.660.00.00.0008; 008; 005; 005; 001; 001; 007; 007; 006; 0040.53; 0.53; 0.51; 0.51; 0.50; 0.49; 0.39; 0.39; 0.38; 0.340.69; 0.68; 0.65; 0.65; 0.65; 0.65; 0.51; 0.51; 0.39; 0.47
018--0.510.670.50.650.020.020.02005; 005; 007; 007; 001; 001; 006; 004; 010; 0080.47; 0.47; 0.39; 0.38; 0.35; 0.35; 0.31; 0.31; 0.30; 0.290.61; 0.61; 0.51; 0.52; 0.47; 0.47; 0.30; 0.33; 0.27; 0.39
019--0.450.60.450.60.030.020.02004; 004; 002; 002; 001; 009; 001; 005; 009; 0050.45; 0.45; 0.44; 0.44; 0.43; 0.43; 0.43; 0.43; 0.42; 0.420.58; 0.58; 0.57; 0.57; 0.57; 0.54; 0.57; 0.55; 0.54; 0.55