| ## |
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 |
130 |
37 |
38129 |
◊ |
A |
x,y,z |
1_555 |
128 |
36 |
38568 |
1147.4 |
-17.5 |
0.054 |
13 |
0 |
0 |
0.178 |
| 2 |
2 |
|
B |
62 |
17 |
38129 |
◊ |
A |
x-1/2,y-1/2,z-1 |
3_444 |
46 |
14 |
38568 |
489.9 |
-4.5 |
0.346 |
4 |
6 |
0 |
0.000 |
| 3 |
3 |
|
B |
39 |
10 |
38129 |
◊ |
A |
-x+1/2,y-1/2,-z-1 |
4_544 |
47 |
12 |
38568 |
419.7 |
-7.6 |
0.071 |
1 |
0 |
0 |
0.000 |
| 4 |
4 |
|
A |
46 |
15 |
38568 |
x |
A |
-x+1/2,y-1/2,-z |
4_545 |
43 |
12 |
38568 |
395.3 |
1.2 |
0.856 |
9 |
3 |
0 |
0.000 |
| 5 |
5 |
|
B |
39 |
14 |
38129 |
x |
B |
-x+1/2,y-1/2,-z-1 |
4_544 |
38 |
12 |
38129 |
324.9 |
-1.1 |
0.593 |
0 |
0 |
0 |
0.000 |
| 6 |
6 |
|
B |
27 |
10 |
38129 |
◊ |
B |
-x,y,-z-1 |
2_554 |
27 |
10 |
38129 |
258.5 |
-1.4 |
0.557 |
5 |
0 |
0 |
0.000 |
| 7 |
7 |
|
B |
26 |
10 |
38129 |
◊ |
A |
x,y-1,z |
1_545 |
27 |
8 |
38568 |
232.5 |
-0.6 |
0.666 |
2 |
0 |
0 |
0.000 |
| 8 |
8 |
|
[GOL]A:1103 |
6 |
1 |
216 |
f |
A |
x,y,z |
1_555 |
28 |
10 |
38568 |
144.3 |
-1.5 |
0.432 |
0 |
0 |
0 |
0.027 |
9 |
|
[GOL]B:1104 |
6 |
1 |
217 |
f |
B |
x,y,z |
1_555 |
27 |
10 |
38129 |
140.8 |
-1.6 |
0.422 |
1 |
0 |
0 |
0.027 |
| Average: |
142.6 |
-1.5 |
0.427 |
1 |
0 |
0 |
0.027 |
| 9 |
10 |
|
[GOL]A:1107 |
6 |
1 |
219 |
f |
A |
x,y,z |
1_555 |
28 |
12 |
38568 |
136.9 |
-1.1 |
0.514 |
5 |
0 |
0 |
0.025 |
| 10 |
11 |
|
[ACT]A:1105 |
4 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
25 |
9 |
38568 |
132.2 |
-1.0 |
0.645 |
1 |
0 |
0 |
0.011 |
| 11 |
12 |
|
[ACT]B:1107 |
4 |
1 |
182 |
f |
B |
x,y,z |
1_555 |
23 |
10 |
38129 |
125.2 |
-1.0 |
0.606 |
1 |
0 |
0 |
0.011 |
| 12 |
13 |
|
[GOL]B:1103 |
6 |
1 |
220 |
f |
B |
x,y,z |
1_555 |
22 |
7 |
38129 |
123.0 |
-0.7 |
0.513 |
5 |
0 |
0 |
0.042 |
14 |
|
[GOL]A:1102 |
6 |
1 |
219 |
f |
A |
x,y,z |
1_555 |
21 |
7 |
38568 |
122.9 |
-0.7 |
0.525 |
4 |
0 |
0 |
0.042 |
| Average: |
122.9 |
-0.7 |
0.519 |
5 |
0 |
0 |
0.042 |
| 13 |
15 |
|
[ACT]B:1108 |
4 |
1 |
183 |
f |
B |
x,y,z |
1_555 |
19 |
10 |
38129 |
117.1 |
-0.2 |
0.732 |
4 |
0 |
0 |
0.015 |
| 14 |
16 |
|
[ACT]A:1108 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
18 |
10 |
38568 |
115.3 |
-0.2 |
0.735 |
4 |
0 |
0 |
0.015 |
| 15 |
17 |
|
[ACT]B:1109 |
4 |
1 |
181 |
f |
B |
x,y,z |
1_555 |
20 |
9 |
38129 |
105.1 |
0.5 |
0.818 |
1 |
0 |
0 |
0.000 |
| 16 |
18 |
|
[ACT]B:1105 |
4 |
1 |
183 |
f |
B |
x,y,z |
1_555 |
19 |
8 |
38129 |
104.4 |
-0.8 |
0.659 |
0 |
0 |
0 |
0.006 |
| 17 |
19 |
|
[ACT]A:1106 |
4 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
14 |
8 |
38568 |
102.4 |
-1.9 |
0.383 |
0 |
0 |
0 |
0.014 |
| 18 |
20 |
|
[ACT]B:1114 |
4 |
1 |
183 |
f |
B |
x,y,z |
1_555 |
18 |
9 |
38129 |
100.4 |
-0.9 |
0.615 |
0 |
0 |
0 |
0.007 |
| 19 |
21 |
|
[ACT]A:1104 |
4 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
18 |
10 |
38568 |
98.9 |
-0.3 |
0.730 |
1 |
0 |
0 |
0.006 |
| 20 |
22 |
|
[ACT]B:1106 |
4 |
1 |
183 |
f |
B |
x,y,z |
1_555 |
15 |
7 |
38129 |
97.7 |
-0.7 |
0.532 |
3 |
0 |
0 |
0.016 |
| 21 |
23 |
|
[ACT]B:1111 |
4 |
1 |
183 |
f |
B |
x,y,z |
1_555 |
15 |
8 |
38129 |
92.6 |
0.1 |
0.770 |
3 |
0 |
0 |
0.010 |
| 22 |
24 |
|
[GOL]B:1102 |
6 |
1 |
215 |
f |
B |
x,y,z |
1_555 |
13 |
6 |
38129 |
92.4 |
0.5 |
0.719 |
3 |
0 |
0 |
0.006 |
| 23 |
25 |
|
[ACT]B:1113 |
4 |
1 |
183 |
◊ |
B |
x,y,z |
1_555 |
13 |
4 |
38129 |
88.7 |
-0.5 |
0.663 |
0 |
0 |
0 |
0.000 |
| 24 |
26 |
|
[GOL]B:1102 |
6 |
1 |
215 |
◊ |
A |
x-1/2,y-1/2,z-1 |
3_444 |
13 |
6 |
38568 |
85.3 |
0.7 |
0.706 |
1 |
0 |
0 |
0.000 |
| 25 |
27 |
|
[ACT]B:1110 |
4 |
1 |
184 |
f |
A |
x-1/2,y-1/2,z-1 |
3_444 |
14 |
5 |
38568 |
78.0 |
-0.3 |
0.707 |
0 |
0 |
0 |
0.003 |
| 26 |
28 |
|
B |
10 |
5 |
38129 |
◊ |
[GOL]B:1112 |
-x+1/2,y-1/2,-z-1 |
4_544 |
5 |
1 |
217 |
77.2 |
0.2 |
0.612 |
0 |
0 |
0 |
0.000 |
| 27 |
29 |
|
[GOL]B:1112 |
6 |
1 |
217 |
f |
B |
x,y,z |
1_555 |
12 |
4 |
38129 |
70.9 |
0.1 |
0.640 |
1 |
0 |
0 |
0.003 |
| 28 |
30 |
|
[ACT]B:1113 |
4 |
1 |
183 |
f |
A |
x,y-1,z |
1_545 |
10 |
4 |
38568 |
62.1 |
-0.3 |
0.704 |
1 |
0 |
0 |
0.006 |
| 29 |
31 |
|
[GOL]B:1104 |
4 |
1 |
217 |
f |
[GOL]B:1103 |
x,y,z |
1_555 |
4 |
1 |
220 |
41.9 |
0.1 |
0.599 |
1 |
0 |
0 |
0.007 |
32 |
|
[GOL]A:1103 |
4 |
1 |
216 |
f |
[GOL]A:1102 |
x,y,z |
1_555 |
4 |
1 |
219 |
39.5 |
-0.1 |
0.556 |
1 |
0 |
0 |
0.007 |
| Average: |
40.7 |
-0.0 |
0.578 |
1 |
0 |
0 |
0.007 |
| 30 |
33 |
|
[ACT]B:1110 |
3 |
1 |
184 |
◊ |
B |
x,y,z |
1_555 |
4 |
2 |
38129 |
37.5 |
0.8 |
0.888 |
1 |
0 |
0 |
0.000 |
| 31 |
34 |
|
[ZN]B:1101 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
7 |
5 |
38129 |
37.5 |
-27.1 |
0.000 |
0 |
0 |
0 |
0.405 |
35 |
|
[ZN]A:1101 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
5 |
5 |
38568 |
36.7 |
-26.0 |
0.000 |
0 |
0 |
0 |
0.405 |
| Average: |
37.1 |
-26.6 |
0.000 |
0 |
0 |
0 |
0.405 |
| 32 |
36 |
|
[ACT]A:1108 |
3 |
1 |
184 |
f |
[ZN]A:1101 |
x,y,z |
1_555 |
1 |
1 |
98 |
31.0 |
-12.6 |
0.000 |
0 |
0 |
0 |
0.190 |
37 |
|
[ACT]B:1108 |
3 |
1 |
183 |
f |
[ZN]B:1101 |
x,y,z |
1_555 |
1 |
1 |
98 |
30.3 |
-12.3 |
0.000 |
0 |
0 |
0 |
0.190 |
| Average: |
30.6 |
-12.4 |
0.000 |
0 |
0 |
0 |
0.190 |
| 33 |
38 |
|
[ACT]B:1105 |
3 |
1 |
183 |
◊ |
A |
x-1/2,y-1/2,z-1 |
3_444 |
4 |
2 |
38568 |
29.0 |
-0.1 |
0.492 |
0 |
0 |
0 |
0.000 |
| 34 |
39 |
|
[ACT]B:1106 |
1 |
1 |
183 |
◊ |
A |
-x+1/2,y-1/2,-z-1 |
4_544 |
1 |
1 |
38568 |
6.8 |
-0.0 |
0.644 |
0 |
0 |
0 |
0.000 |
|