## |
Structure 1 |
× |
Structure 2 |
interface area, Å2 |
ΔiG kcal/mol |
ΔiG P-value |
NHB |
NSB |
NDS |
CSS |
Id |
NN |
«» |
Range |
iNat |
iNres |
Surface Å2 |
Range |
Symmetry op-n |
Sym.ID |
iNat |
iNres |
Surface Å2 |
1 |
1 |
|
B |
85 |
22 |
9625 |
◊ |
A |
x,y,z |
1_555 |
83 |
23 |
9707 |
710.5 |
-4.3 |
0.360 |
7 |
0 |
0 |
0.031 |
2 |
2 |
|
B |
64 |
21 |
9625 |
◊ |
A |
-x+y+2/3,-x+1/3,z+1/3 |
6_555 |
59 |
18 |
9707 |
524.7 |
-0.5 |
0.601 |
4 |
4 |
0 |
0.012 |
3 |
3 |
|
B |
64 |
16 |
9625 |
x |
B |
-y,x-y,z |
2_555 |
53 |
14 |
9625 |
463.7 |
-5.0 |
0.265 |
1 |
0 |
0 |
0.037 |
4 |
|
A |
48 |
14 |
9707 |
x |
A |
-y,x-y,z |
2_555 |
59 |
16 |
9707 |
427.8 |
-2.4 |
0.412 |
3 |
0 |
0 |
0.037 |
Average: |
445.8 |
-3.7 |
0.339 |
2 |
0 |
0 |
0.037 |
4 |
5 |
|
[GNQ]A:401 |
39 |
1 |
826 |
f |
A |
x,y,z |
1_555 |
75 |
25 |
9707 |
452.8 |
0.3 |
0.216 |
8 |
0 |
0 |
0.031 |
6 |
|
[GNQ]B:501 |
39 |
1 |
819 |
f |
B |
x,y,z |
1_555 |
74 |
25 |
9625 |
447.2 |
0.5 |
0.226 |
10 |
0 |
0 |
0.031 |
Average: |
450.0 |
0.4 |
0.221 |
9 |
0 |
0 |
0.031 |
5 |
7 |
|
B |
22 |
6 |
9625 |
◊ |
A |
-y+2/3,x-y+1/3,z+1/3 |
5_555 |
19 |
8 |
9707 |
128.5 |
1.4 |
0.756 |
0 |
0 |
0 |
0.000 |
6 |
8 |
|
[GNQ]B:501 |
14 |
1 |
819 |
◊ |
A |
x,y,z |
1_555 |
21 |
6 |
9707 |
117.3 |
1.5 |
0.302 |
0 |
0 |
0 |
0.000 |
9 |
|
[GNQ]A:401 |
14 |
1 |
826 |
◊ |
B |
x,y,z |
1_555 |
21 |
5 |
9625 |
114.9 |
1.5 |
0.315 |
0 |
0 |
0 |
0.000 |
Average: |
116.1 |
1.5 |
0.309 |
0 |
0 |
0 |
0.000 |
7 |
10 |
|
B |
13 |
6 |
9625 |
x |
B |
-x+y+2/3,-x+1/3,z+1/3 |
6_555 |
15 |
5 |
9625 |
99.9 |
-1.2 |
0.259 |
0 |
0 |
0 |
0.000 |
8 |
11 |
|
B |
11 |
4 |
9625 |
◊ |
[GNQ]B:501 |
-y,x-y,z |
2_555 |
11 |
1 |
819 |
90.7 |
-1.0 |
0.219 |
0 |
0 |
0 |
0.008 |
12 |
|
[GNQ]A:401 |
11 |
1 |
826 |
◊ |
A |
-y,x-y,z |
2_555 |
11 |
4 |
9707 |
88.5 |
-1.1 |
0.211 |
0 |
0 |
0 |
0.008 |
Average: |
89.6 |
-1.0 |
0.215 |
0 |
0 |
0 |
0.008 |
9 |
13 |
|
[ZN]A:702 |
1 |
1 |
98 |
cf |
A |
x,y,z |
1_555 |
11 |
5 |
9707 |
52.5 |
-34.5 |
0.000 |
0 |
0 |
0 |
0.289 |
14 |
|
[ZN]B:602 |
1 |
1 |
98 |
cf |
B |
x,y,z |
1_555 |
11 |
5 |
9625 |
50.8 |
-33.9 |
0.000 |
0 |
0 |
0 |
0.289 |
Average: |
51.7 |
-34.2 |
0.000 |
0 |
0 |
0 |
0.289 |
10 |
15 |
|
[ZN]A:703 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
9 |
5 |
9707 |
46.3 |
-20.7 |
0.000 |
0 |
0 |
0 |
0.088 |
11 |
16 |
|
[CL]B:801 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
7 |
5 |
9625 |
38.1 |
-5.6 |
0.000 |
0 |
0 |
0 |
0.047 |
17 |
|
[CL]A:802 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
7 |
5 |
9707 |
38.1 |
-5.5 |
0.000 |
0 |
0 |
0 |
0.047 |
Average: |
38.1 |
-5.5 |
0.000 |
0 |
0 |
0 |
0.047 |
12 |
18 |
|
[GNQ]B:501 |
4 |
1 |
819 |
◊ |
[GNQ]A:401 |
x,y,z |
1_555 |
5 |
1 |
826 |
37.4 |
1.5 |
0.533 |
2 |
0 |
0 |
0.000 |
13 |
19 |
|
A |
4 |
2 |
9707 |
◊ |
B |
-x+y+2/3,-x+1/3,z-2/3 |
6_554 |
3 |
1 |
9625 |
36.3 |
1.0 |
0.859 |
2 |
0 |
0 |
0.000 |
14 |
20 |
|
[ZN]B:603 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
8 |
3 |
9625 |
36.1 |
-24.6 |
0.000 |
0 |
0 |
0 |
0.104 |
15 |
21 |
|
[ZN]B:603 |
1 |
1 |
98 |
◊ |
A |
-x+y+2/3,-x+1/3,z+1/3 |
6_555 |
7 |
3 |
9707 |
29.7 |
-14.2 |
0.000 |
0 |
0 |
0 |
0.060 |
16 |
22 |
|
[GNQ]A:401 |
6 |
1 |
826 |
f |
[CL]A:802 |
x,y,z |
1_555 |
1 |
1 |
125 |
29.6 |
-2.0 |
0.000 |
0 |
0 |
0 |
0.017 |
23 |
|
[GNQ]B:501 |
6 |
1 |
819 |
f |
[CL]B:801 |
x,y,z |
1_555 |
1 |
1 |
125 |
28.8 |
-2.0 |
0.000 |
0 |
0 |
0 |
0.017 |
Average: |
29.2 |
-2.0 |
0.000 |
0 |
0 |
0 |
0.017 |
17 |
24 |
|
[ZN]A:701 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
9 |
6 |
9707 |
28.6 |
-18.3 |
0.000 |
0 |
0 |
0 |
0.154 |
25 |
|
[ZN]B:601 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
9 |
6 |
9625 |
28.5 |
-18.2 |
0.000 |
0 |
0 |
0 |
0.154 |
Average: |
28.6 |
-18.3 |
0.000 |
0 |
0 |
0 |
0.154 |
18 |
26 |
|
[CL]A:802 |
1 |
1 |
125 |
◊ |
B |
x,y,z |
1_555 |
6 |
3 |
9625 |
27.8 |
-3.0 |
0.000 |
0 |
0 |
0 |
0.025 |
27 |
|
[CL]B:801 |
1 |
1 |
125 |
◊ |
A |
x,y,z |
1_555 |
5 |
3 |
9707 |
26.7 |
-2.8 |
0.000 |
0 |
0 |
0 |
0.025 |
Average: |
27.2 |
-2.9 |
0.000 |
0 |
0 |
0 |
0.025 |
19 |
28 |
|
[GNQ]A:401 |
7 |
1 |
826 |
f |
[ZN]A:701 |
x,y,z |
1_555 |
1 |
1 |
98 |
27.1 |
-11.9 |
0.000 |
0 |
0 |
0 |
0.100 |
29 |
|
[GNQ]B:501 |
8 |
1 |
819 |
f |
[ZN]B:601 |
x,y,z |
1_555 |
1 |
1 |
98 |
26.8 |
-11.8 |
0.000 |
0 |
0 |
0 |
0.100 |
Average: |
26.9 |
-11.8 |
0.000 |
0 |
0 |
0 |
0.100 |
20 |
30 |
|
[CL]B:801 |
1 |
1 |
125 |
f |
[ZN]B:601 |
x,y,z |
1_555 |
1 |
1 |
98 |
19.4 |
-10.2 |
0.000 |
0 |
0 |
0 |
0.043 |
21 |
31 |
|
[CL]A:802 |
1 |
1 |
125 |
f |
[ZN]A:701 |
x,y,z |
1_555 |
1 |
1 |
98 |
18.8 |
-10.0 |
0.000 |
0 |
0 |
0 |
0.042 |
22 |
32 |
|
[ZN]B:602 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
9707 |
13.4 |
-5.2 |
0.000 |
0 |
0 |
0 |
0.042 |
33 |
|
[ZN]A:702 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
9625 |
11.8 |
-4.7 |
0.000 |
0 |
0 |
0 |
0.042 |
Average: |
12.6 |
-4.9 |
0.000 |
0 |
0 |
0 |
0.042 |
23 |
34 |
|
A |
1 |
1 |
9707 |
x |
A |
-y+2/3,x-y+1/3,z+1/3 |
5_555 |
2 |
1 |
9707 |
13.1 |
-0.1 |
0.166 |
0 |
0 |
0 |
0.000 |
24 |
35 |
|
B |
1 |
1 |
9625 |
◊ |
A |
-y,x-y,z |
2_555 |
1 |
1 |
9707 |
11.0 |
0.3 |
0.838 |
0 |
0 |
0 |
0.000 |
25 |
36 |
|
B |
1 |
1 |
9625 |
◊ |
[ZN]A:703 |
-x+y+2/3,-x+1/3,z+1/3 |
6_555 |
1 |
1 |
98 |
8.5 |
-3.6 |
0.000 |
0 |
0 |
0 |
0.015 |
26 |
37 |
|
[ZN]B:601 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
9707 |
1.0 |
-0.3 |
0.000 |
0 |
0 |
0 |
0.003 |
38 |
|
[ZN]A:701 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
9625 |
1.0 |
-0.3 |
0.000 |
0 |
0 |
0 |
0.003 |
Average: |
1.0 |
-0.3 |
0.000 |
0 |
0 |
0 |
0.003 |
|