## |
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 |
|
C |
128 |
37 |
7228 |
◊ |
B |
x,y,z |
1_555 |
114 |
30 |
7470 |
1082.9 |
-5.2 |
0.515 |
21 |
6 |
0 |
0.155 |
2 |
|
B |
128 |
36 |
7470 |
◊ |
A |
x,y,z |
1_555 |
109 |
31 |
7799 |
1035.6 |
-6.5 |
0.425 |
16 |
4 |
0 |
0.155 |
3 |
|
C |
109 |
31 |
7228 |
◊ |
A |
x,y,z |
1_555 |
124 |
36 |
7799 |
1014.7 |
-5.0 |
0.492 |
18 |
5 |
0 |
0.155 |
Average: |
1044.4 |
-5.6 |
0.477 |
18 |
5 |
0 |
0.155 |
2 |
4 |
|
B |
53 |
16 |
7470 |
◊ |
A |
-x,y,-z-1 |
2_554 |
51 |
13 |
7799 |
504.0 |
1.1 |
0.562 |
9 |
8 |
0 |
0.000 |
3 |
5 |
|
C |
47 |
15 |
7228 |
◊ |
A |
-x+1/2,y-1/2,-z |
4_545 |
43 |
13 |
7799 |
392.1 |
0.4 |
0.693 |
3 |
2 |
0 |
0.000 |
4 |
6 |
|
B |
48 |
14 |
7470 |
x |
B |
-x+1/2,y-1/2,-z-1 |
4_544 |
29 |
8 |
7470 |
347.3 |
-3.1 |
0.375 |
2 |
0 |
0 |
0.000 |
5 |
7 |
|
A |
34 |
13 |
7799 |
◊ |
A |
-x,y,-z |
2_555 |
34 |
13 |
7799 |
269.1 |
1.5 |
0.777 |
2 |
0 |
0 |
0.000 |
6 |
8 |
|
C |
23 |
7 |
7228 |
x |
C |
-x+1/2,y-1/2,-z |
4_545 |
23 |
8 |
7228 |
226.6 |
-0.2 |
0.590 |
3 |
0 |
0 |
0.000 |
7 |
9 |
|
[535]A:164 |
14 |
1 |
370 |
f |
A |
x,y,z |
1_555 |
28 |
13 |
7799 |
215.3 |
-1.3 |
0.254 |
1 |
0 |
0 |
0.006 |
8 |
10 |
|
[535]C:164 |
14 |
1 |
378 |
f |
C |
x,y,z |
1_555 |
22 |
10 |
7228 |
194.6 |
-1.8 |
0.228 |
0 |
0 |
0 |
0.006 |
9 |
11 |
|
[535]B:164 |
12 |
1 |
379 |
f |
B |
x,y,z |
1_555 |
27 |
10 |
7470 |
188.4 |
-0.7 |
0.339 |
0 |
0 |
0 |
0.003 |
10 |
12 |
|
C |
8 |
3 |
7228 |
◊ |
B |
-x+1/2,y-1/2,-z-1 |
4_544 |
11 |
3 |
7470 |
79.3 |
0.7 |
0.757 |
2 |
0 |
0 |
0.000 |
11 |
13 |
|
[CL]A:165 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
12 |
7 |
7799 |
70.7 |
-12.2 |
0.000 |
0 |
0 |
0 |
0.044 |
12 |
14 |
|
[535]B:164 |
6 |
1 |
379 |
◊ |
C |
x,y,z |
1_555 |
6 |
3 |
7228 |
69.1 |
3.2 |
0.782 |
0 |
0 |
0 |
0.000 |
13 |
15 |
|
[K]A:166 |
1 |
1 |
216 |
◊ |
B |
x,y,z |
1_555 |
10 |
6 |
7470 |
66.9 |
-38.3 |
0.000 |
0 |
0 |
0 |
0.386 |
16 |
|
[K]A:166 |
1 |
1 |
216 |
◊ |
C |
x,y,z |
1_555 |
11 |
6 |
7228 |
63.8 |
-35.8 |
0.000 |
0 |
0 |
0 |
0.386 |
17 |
|
[K]A:166 |
1 |
1 |
216 |
◊ |
A |
x,y,z |
1_555 |
10 |
5 |
7799 |
61.0 |
-33.9 |
0.000 |
0 |
0 |
0 |
0.386 |
Average: |
63.9 |
-36.0 |
0.000 |
0 |
0 |
0 |
0.386 |
14 |
18 |
|
B |
6 |
2 |
7470 |
◊ |
C |
-x+1/2,y-1/2,-z-1 |
4_544 |
9 |
2 |
7228 |
65.9 |
0.4 |
0.688 |
2 |
0 |
0 |
0.000 |
15 |
19 |
|
[ACT]C:165 |
4 |
1 |
183 |
◊ |
C |
x,y,z |
1_555 |
7 |
3 |
7228 |
62.4 |
0.0 |
0.632 |
3 |
0 |
0 |
0.005 |
16 |
20 |
|
[ACT]C:165 |
3 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
7 |
3 |
7799 |
62.4 |
-0.8 |
0.582 |
2 |
0 |
0 |
0.006 |
17 |
21 |
|
[535]A:164 |
5 |
1 |
370 |
◊ |
B |
x,y,z |
1_555 |
8 |
3 |
7470 |
61.3 |
2.2 |
0.716 |
0 |
0 |
0 |
0.000 |
18 |
22 |
|
[535]C:164 |
4 |
1 |
378 |
◊ |
A |
x,y,z |
1_555 |
9 |
3 |
7799 |
58.8 |
2.4 |
0.766 |
0 |
0 |
0 |
0.000 |
19 |
23 |
|
[ZN]C:163 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
7 |
3 |
7228 |
36.6 |
-26.0 |
0.000 |
0 |
0 |
0 |
0.266 |
24 |
|
[ZN]A:163 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
7 |
3 |
7799 |
34.8 |
-24.7 |
0.000 |
0 |
0 |
0 |
0.266 |
25 |
|
[ZN]B:163 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
6 |
3 |
7470 |
34.4 |
-23.8 |
0.000 |
0 |
0 |
0 |
0.266 |
Average: |
35.3 |
-24.8 |
0.000 |
0 |
0 |
0 |
0.266 |
20 |
26 |
|
[535]C:164 |
4 |
1 |
378 |
f |
[ZN]C:163 |
x,y,z |
1_555 |
1 |
1 |
98 |
30.7 |
-13.1 |
0.000 |
0 |
0 |
0 |
0.136 |
27 |
|
[535]A:164 |
3 |
1 |
370 |
f |
[ZN]A:163 |
x,y,z |
1_555 |
1 |
1 |
98 |
30.2 |
-12.9 |
0.000 |
0 |
0 |
0 |
0.136 |
28 |
|
[535]B:164 |
4 |
1 |
379 |
f |
[ZN]B:163 |
x,y,z |
1_555 |
1 |
1 |
98 |
29.6 |
-12.1 |
0.000 |
0 |
0 |
0 |
0.136 |
Average: |
30.2 |
-12.7 |
0.000 |
0 |
0 |
0 |
0.136 |
21 |
29 |
|
[ACT]C:165 |
2 |
1 |
183 |
◊ |
B |
x,y,z |
1_555 |
6 |
3 |
7470 |
29.2 |
-0.6 |
0.474 |
0 |
0 |
0 |
0.002 |
22 |
30 |
|
A |
4 |
1 |
7799 |
◊ |
A |
-x,y,-z-1 |
2_554 |
4 |
1 |
7799 |
26.5 |
0.8 |
0.822 |
0 |
0 |
0 |
0.000 |
23 |
31 |
|
B |
1 |
1 |
7470 |
◊ |
B |
-x,y,-z-1 |
2_554 |
1 |
1 |
7470 |
9.1 |
0.3 |
0.850 |
0 |
0 |
0 |
0.000 |
24 |
32 |
|
[ZN]B:163 |
1 |
1 |
98 |
◊ |
C |
x,y,z |
1_555 |
1 |
1 |
7228 |
7.8 |
-2.2 |
0.000 |
0 |
0 |
0 |
0.013 |
33 |
|
[ZN]A:163 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
7470 |
4.5 |
-1.6 |
0.000 |
0 |
0 |
0 |
0.013 |
Average: |
6.2 |
-1.9 |
0.000 |
0 |
0 |
0 |
0.013 |
25 |
34 |
|
C |
3 |
1 |
7228 |
◊ |
[ACT]C:165 |
-x+1/2,y-1/2,-z |
4_545 |
1 |
1 |
183 |
3.2 |
0.0 |
0.566 |
0 |
0 |
0 |
0.000 |
|