## |
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 |
|
D |
147 |
37 |
13229 |
◊ |
C |
x,y,z |
1_555 |
148 |
38 |
13736 |
1591.0 |
-14.8 |
0.104 |
18 |
2 |
0 |
0.446 |
2 |
|
B |
149 |
38 |
13938 |
◊ |
A |
x,y,z |
1_555 |
148 |
38 |
13607 |
1577.3 |
-14.1 |
0.146 |
14 |
0 |
0 |
0.446 |
Average: |
1584.1 |
-14.5 |
0.125 |
16 |
1 |
0 |
0.446 |
2 |
3 |
|
C |
93 |
28 |
13736 |
◊ |
B |
x,y,z |
1_555 |
96 |
28 |
13938 |
814.9 |
-1.9 |
0.639 |
6 |
1 |
0 |
0.000 |
4 |
|
D |
88 |
27 |
13229 |
◊ |
A |
x,y,z |
1_555 |
86 |
27 |
13607 |
728.6 |
-3.4 |
0.533 |
6 |
0 |
0 |
0.000 |
Average: |
771.7 |
-2.6 |
0.586 |
6 |
1 |
0 |
0.000 |
3 |
5 |
|
[DGT]D:500 |
30 |
1 |
588 |
f |
D |
x,y,z |
1_555 |
51 |
20 |
13229 |
381.6 |
0.7 |
0.616 |
16 |
0 |
0 |
0.245 |
6 |
|
[DGT]C:500 |
30 |
1 |
588 |
f |
C |
x,y,z |
1_555 |
53 |
21 |
13736 |
379.9 |
0.8 |
0.618 |
16 |
0 |
0 |
0.245 |
7 |
|
[DGT]B:500 |
30 |
1 |
584 |
f |
B |
x,y,z |
1_555 |
52 |
20 |
13938 |
379.7 |
0.7 |
0.625 |
16 |
0 |
0 |
0.245 |
8 |
|
[DGT]A:500 |
30 |
1 |
587 |
f |
A |
x,y,z |
1_555 |
52 |
21 |
13607 |
378.1 |
1.3 |
0.656 |
17 |
0 |
0 |
0.245 |
Average: |
379.8 |
0.9 |
0.629 |
16 |
0 |
0 |
0.245 |
4 |
9 |
|
B |
41 |
11 |
13938 |
◊ |
A |
-y,x+1,z+1/4 |
3_565 |
42 |
10 |
13607 |
380.4 |
-4.8 |
0.237 |
4 |
2 |
0 |
0.000 |
5 |
10 |
|
C |
26 |
7 |
13736 |
◊ |
B |
-y+1,x+1,z+1/4 |
3_665 |
18 |
4 |
13938 |
208.8 |
-1.7 |
0.343 |
1 |
1 |
0 |
0.000 |
6 |
11 |
|
[PEG]A:293 |
7 |
1 |
262 |
f |
A |
x,y,z |
1_555 |
41 |
17 |
13607 |
181.2 |
4.2 |
0.500 |
5 |
0 |
0 |
0.000 |
7 |
12 |
|
B |
25 |
8 |
13938 |
x |
B |
-y,x+1,z+1/4 |
3_565 |
19 |
6 |
13938 |
172.3 |
-1.9 |
0.350 |
2 |
0 |
0 |
0.000 |
13 |
|
A |
18 |
6 |
13607 |
x |
A |
-y,x+1,z+1/4 |
3_565 |
23 |
7 |
13607 |
161.9 |
-1.8 |
0.337 |
2 |
0 |
0 |
0.000 |
Average: |
167.1 |
-1.9 |
0.343 |
2 |
0 |
0 |
0.000 |
8 |
14 |
|
A |
19 |
5 |
13607 |
◊ |
D |
-y,x,z+1/4 |
3_555 |
14 |
5 |
13229 |
146.0 |
-2.0 |
0.202 |
0 |
0 |
0 |
0.000 |
9 |
15 |
|
[PEG]C:293 |
7 |
1 |
263 |
f |
D |
x,y,z |
1_555 |
23 |
7 |
13229 |
114.8 |
1.2 |
0.235 |
4 |
0 |
0 |
0.011 |
10 |
16 |
|
[PEG]A:294 |
7 |
1 |
264 |
f |
A |
x,y,z |
1_555 |
23 |
6 |
13607 |
113.0 |
1.3 |
0.234 |
1 |
0 |
0 |
0.000 |
11 |
17 |
|
[PEG]A:294 |
7 |
1 |
264 |
◊ |
B |
x,y,z |
1_555 |
20 |
6 |
13938 |
108.4 |
1.8 |
0.272 |
1 |
0 |
0 |
0.000 |
12 |
18 |
|
[PEG]C:293 |
7 |
1 |
263 |
◊ |
C |
x,y,z |
1_555 |
20 |
5 |
13736 |
107.5 |
1.7 |
0.277 |
1 |
0 |
0 |
0.000 |
13 |
19 |
|
C |
11 |
4 |
13736 |
◊ |
D |
-x,-y+1,z-1/2 |
2_564 |
8 |
4 |
13229 |
64.6 |
-0.9 |
0.392 |
0 |
0 |
0 |
0.000 |
14 |
20 |
|
B |
5 |
2 |
13938 |
◊ |
C |
-x,-y+1,z-1/2 |
2_564 |
7 |
4 |
13736 |
57.6 |
1.5 |
0.832 |
1 |
0 |
0 |
0.000 |
15 |
21 |
|
B |
3 |
1 |
13938 |
◊ |
D |
-x,-y+1,z-1/2 |
2_564 |
7 |
3 |
13229 |
50.4 |
0.1 |
0.572 |
0 |
0 |
0 |
0.000 |
16 |
22 |
|
[MG]A:501 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
10 |
7 |
13607 |
49.2 |
-6.0 |
0.000 |
0 |
0 |
0 |
0.220 |
23 |
|
[MG]C:501 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
10 |
6 |
13736 |
49.0 |
-6.1 |
0.000 |
0 |
0 |
0 |
0.220 |
24 |
|
[MG]B:501 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
11 |
7 |
13938 |
49.0 |
-6.2 |
0.000 |
0 |
0 |
0 |
0.220 |
Average: |
49.1 |
-6.1 |
0.000 |
0 |
0 |
0 |
0.220 |
17 |
25 |
|
[MG]B:502 |
1 |
1 |
98 |
f |
[DGT]B:500 |
x,y,z |
1_555 |
6 |
1 |
584 |
42.8 |
-6.6 |
0.000 |
0 |
0 |
0 |
0.120 |
26 |
|
[MG]D:502 |
1 |
1 |
98 |
f |
[DGT]D:500 |
x,y,z |
1_555 |
6 |
1 |
588 |
40.8 |
-6.2 |
0.000 |
0 |
0 |
0 |
0.120 |
Average: |
41.8 |
-6.4 |
0.000 |
0 |
0 |
0 |
0.120 |
18 |
27 |
|
D |
7 |
3 |
13229 |
x |
D |
-y,x,z+1/4 |
3_555 |
3 |
2 |
13229 |
34.5 |
-0.1 |
0.541 |
0 |
0 |
0 |
0.000 |
19 |
28 |
|
C |
4 |
3 |
13736 |
◊ |
A |
-x,-y+1,z-1/2 |
2_564 |
6 |
3 |
13607 |
31.5 |
0.1 |
0.664 |
0 |
0 |
0 |
0.000 |
20 |
29 |
|
[MG]A:501 |
1 |
1 |
98 |
f |
[DGT]A:500 |
x,y,z |
1_555 |
5 |
1 |
587 |
29.8 |
-4.1 |
0.000 |
0 |
0 |
0 |
0.144 |
30 |
|
[MG]C:501 |
1 |
1 |
98 |
f |
[DGT]C:500 |
x,y,z |
1_555 |
5 |
1 |
588 |
29.6 |
-4.1 |
0.000 |
0 |
0 |
0 |
0.144 |
31 |
|
[MG]B:501 |
1 |
1 |
98 |
f |
[DGT]B:500 |
x,y,z |
1_555 |
5 |
1 |
584 |
29.0 |
-4.0 |
0.000 |
0 |
0 |
0 |
0.144 |
Average: |
29.5 |
-4.0 |
0.000 |
0 |
0 |
0 |
0.144 |
21 |
32 |
|
[DGT]D:500 |
4 |
1 |
588 |
◊ |
C |
x,y,z |
1_555 |
3 |
1 |
13736 |
15.2 |
0.4 |
0.617 |
0 |
0 |
0 |
0.000 |
33 |
|
[DGT]B:500 |
4 |
1 |
584 |
◊ |
A |
x,y,z |
1_555 |
3 |
1 |
13607 |
12.5 |
0.4 |
0.616 |
0 |
0 |
0 |
0.000 |
34 |
|
[DGT]A:500 |
4 |
1 |
587 |
◊ |
B |
x,y,z |
1_555 |
3 |
1 |
13938 |
10.3 |
0.3 |
0.602 |
0 |
0 |
0 |
0.000 |
35 |
|
[DGT]C:500 |
2 |
1 |
588 |
◊ |
D |
x,y,z |
1_555 |
3 |
1 |
13229 |
4.3 |
0.2 |
0.561 |
0 |
0 |
0 |
0.000 |
Average: |
10.6 |
0.3 |
0.599 |
0 |
0 |
0 |
0.000 |
22 |
36 |
|
A |
2 |
2 |
13607 |
◊ |
B |
-y,x+1,z+1/4 |
3_565 |
2 |
2 |
13938 |
12.3 |
-0.4 |
0.321 |
0 |
0 |
0 |
0.000 |
23 |
37 |
|
[MG]D:502 |
1 |
1 |
98 |
f |
D |
x,y,z |
1_555 |
1 |
1 |
13229 |
9.9 |
-0.8 |
0.000 |
0 |
0 |
0 |
0.016 |
38 |
|
[MG]B:502 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
1 |
1 |
13938 |
7.2 |
-0.4 |
0.000 |
0 |
0 |
0 |
0.016 |
Average: |
8.6 |
-0.6 |
0.000 |
0 |
0 |
0 |
0.016 |
|