| ## |
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 |
172 |
54 |
20470 |
◊ |
A |
x,y,z |
1_555 |
174 |
51 |
21021 |
1535.3 |
-3.0 |
0.635 |
21 |
0 |
0 |
0.012 |
| 2 |
2 |
|
A |
114 |
34 |
21021 |
x |
A |
-x,y-1/2,-z+1/2 |
3_545 |
114 |
32 |
21021 |
965.5 |
-0.9 |
0.623 |
12 |
2 |
0 |
0.000 |
| 3 |
3 |
|
A |
70 |
22 |
21021 |
◊ |
B |
-x,y-1/2,-z+1/2 |
3_545 |
79 |
27 |
20470 |
673.4 |
-4.8 |
0.316 |
3 |
0 |
0 |
0.000 |
| 4 |
4 |
|
A |
59 |
15 |
21021 |
◊ |
B |
x-1/2,-y+1/2,-z |
4_455 |
66 |
21 |
20470 |
498.8 |
1.5 |
0.724 |
5 |
0 |
0 |
0.000 |
| 5 |
5 |
|
B |
45 |
15 |
20470 |
◊ |
A |
-x+1/2,-y,z-1/2 |
2_554 |
42 |
16 |
21021 |
433.5 |
-3.0 |
0.321 |
6 |
0 |
0 |
0.000 |
| 6 |
6 |
|
[QTT]B:601 |
21 |
1 |
556 |
f |
B |
x,y,z |
1_555 |
57 |
15 |
20470 |
352.5 |
2.4 |
0.387 |
2 |
0 |
0 |
0.000 |
7 |
|
[QTT]A:602 |
22 |
1 |
554 |
f |
A |
x,y,z |
1_555 |
57 |
16 |
21021 |
328.9 |
2.8 |
0.415 |
2 |
0 |
0 |
0.000 |
| Average: |
340.7 |
2.6 |
0.401 |
2 |
0 |
0 |
0.000 |
| 7 |
8 |
|
A |
20 |
7 |
21021 |
◊ |
B |
-x+1,y-1/2,-z+1/2 |
3_645 |
17 |
5 |
20470 |
169.8 |
-1.0 |
0.441 |
0 |
0 |
0 |
0.000 |
| 8 |
9 |
|
[GOL]B:604 |
6 |
1 |
220 |
f |
B |
x,y,z |
1_555 |
23 |
9 |
20470 |
139.4 |
-0.5 |
0.521 |
3 |
0 |
0 |
0.003 |
| 9 |
10 |
|
[GOL]A:615 |
6 |
1 |
218 |
f |
A |
x,y,z |
1_555 |
24 |
9 |
21021 |
138.4 |
-0.2 |
0.570 |
1 |
0 |
0 |
0.002 |
| 10 |
11 |
|
[GOL]A:614 |
6 |
1 |
220 |
f |
A |
x,y,z |
1_555 |
19 |
9 |
21021 |
137.2 |
-0.6 |
0.485 |
4 |
0 |
0 |
0.007 |
| 11 |
12 |
|
[GOL]B:606 |
6 |
1 |
216 |
f |
B |
x,y,z |
1_555 |
22 |
9 |
20470 |
132.1 |
-0.6 |
0.455 |
1 |
0 |
0 |
0.002 |
| 12 |
13 |
|
B |
15 |
7 |
20470 |
x |
B |
-x+1,y-1/2,-z+1/2 |
3_645 |
16 |
6 |
20470 |
130.4 |
-1.0 |
0.388 |
0 |
0 |
0 |
0.000 |
| 13 |
14 |
|
[GOL]A:612 |
6 |
1 |
214 |
f |
A |
x,y,z |
1_555 |
23 |
9 |
21021 |
128.7 |
-0.2 |
0.547 |
5 |
0 |
0 |
0.008 |
| 14 |
15 |
|
[GOL]A:616 |
6 |
1 |
215 |
f |
A |
x,y,z |
1_555 |
20 |
7 |
21021 |
114.9 |
-0.6 |
0.542 |
4 |
0 |
0 |
0.007 |
| 15 |
16 |
|
[GOL]B:603 |
6 |
1 |
218 |
f |
B |
x,y,z |
1_555 |
13 |
6 |
20470 |
95.7 |
-1.2 |
0.354 |
1 |
0 |
0 |
0.003 |
| 16 |
17 |
|
[GOL]B:605 |
6 |
1 |
212 |
f |
A |
x,y,z |
1_555 |
12 |
4 |
21021 |
93.9 |
-0.8 |
0.472 |
2 |
0 |
0 |
0.005 |
| 17 |
18 |
|
[ACT]A:603 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
15 |
7 |
21021 |
92.0 |
-0.6 |
0.617 |
0 |
0 |
0 |
0.002 |
| 18 |
19 |
|
[GOL]B:603 |
5 |
1 |
218 |
◊ |
A |
-x+1/2,-y,z-1/2 |
2_554 |
10 |
6 |
21021 |
89.4 |
-0.8 |
0.401 |
1 |
0 |
0 |
0.000 |
| 19 |
20 |
|
[ACT]A:605 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
14 |
5 |
21021 |
88.6 |
0.2 |
0.733 |
3 |
0 |
0 |
0.003 |
| 20 |
21 |
|
[GOL]A:613 |
6 |
1 |
215 |
f |
A |
x,y,z |
1_555 |
14 |
5 |
21021 |
78.2 |
-0.2 |
0.578 |
1 |
0 |
0 |
0.002 |
| 21 |
22 |
|
A |
14 |
6 |
21021 |
◊ |
B |
x-1,y,z |
1_455 |
9 |
3 |
20470 |
73.3 |
0.6 |
0.682 |
0 |
0 |
0 |
0.000 |
| 22 |
23 |
|
[ACT]A:611 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
8 |
3 |
21021 |
69.6 |
0.5 |
0.750 |
2 |
0 |
0 |
0.001 |
| 23 |
24 |
|
[ACT]A:604 |
4 |
1 |
182 |
◊ |
A |
x,y,z |
1_555 |
12 |
4 |
21021 |
65.3 |
0.7 |
0.806 |
1 |
0 |
0 |
0.000 |
| 24 |
25 |
|
[ACT]A:607 |
4 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
9 |
5 |
21021 |
58.4 |
-0.1 |
0.608 |
1 |
0 |
0 |
0.002 |
| 25 |
26 |
|
[GOL]A:613 |
5 |
1 |
215 |
◊ |
B |
-x,y-1/2,-z+1/2 |
3_545 |
13 |
6 |
20470 |
57.5 |
-0.1 |
0.599 |
0 |
0 |
0 |
0.000 |
| 26 |
27 |
|
[ACT]A:604 |
4 |
1 |
182 |
f |
B |
-x,y-1/2,-z+1/2 |
3_545 |
5 |
3 |
20470 |
56.3 |
0.1 |
0.790 |
2 |
0 |
0 |
0.001 |
| 27 |
28 |
|
[QTT]A:602 |
5 |
1 |
554 |
f |
[FE]A:601 |
x,y,z |
1_555 |
1 |
1 |
137 |
56.0 |
-10.2 |
0.000 |
0 |
0 |
0 |
0.031 |
29 |
|
[QTT]B:601 |
5 |
1 |
556 |
f |
[FE]B:602 |
x,y,z |
1_555 |
1 |
1 |
137 |
53.2 |
-9.9 |
0.000 |
0 |
0 |
0 |
0.031 |
| Average: |
54.6 |
-10.0 |
0.000 |
0 |
0 |
0 |
0.031 |
| 28 |
30 |
|
[MG]B:610 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
11 |
7 |
20470 |
54.2 |
-9.0 |
0.000 |
0 |
0 |
0 |
0.017 |
| 29 |
31 |
|
[MG]B:608 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
10 |
5 |
20470 |
51.8 |
-9.7 |
0.000 |
0 |
0 |
0 |
0.025 |
32 |
|
[MG]A:617 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
11 |
5 |
21021 |
47.3 |
-8.3 |
0.000 |
0 |
0 |
0 |
0.025 |
| Average: |
49.5 |
-9.0 |
0.000 |
0 |
0 |
0 |
0.025 |
| 30 |
33 |
|
[CL]B:611 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
8 |
4 |
20470 |
50.5 |
-7.5 |
0.000 |
0 |
0 |
0 |
0.014 |
| 31 |
34 |
|
[GOL]B:605 |
4 |
1 |
212 |
◊ |
B |
x,y,z |
1_555 |
9 |
4 |
20470 |
50.1 |
0.0 |
0.601 |
2 |
0 |
0 |
0.000 |
| 32 |
35 |
|
[GOL]A:613 |
4 |
1 |
215 |
◊ |
A |
-x,y-1/2,-z+1/2 |
3_545 |
10 |
2 |
21021 |
49.4 |
-0.7 |
0.408 |
0 |
0 |
0 |
0.000 |
| 33 |
36 |
|
[ACT]A:606 |
3 |
1 |
185 |
f |
B |
x-1/2,-y+1/2,-z |
4_455 |
5 |
2 |
20470 |
48.5 |
0.1 |
0.767 |
1 |
0 |
0 |
0.000 |
| 34 |
37 |
|
[ACT]A:608 |
4 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
10 |
5 |
21021 |
46.7 |
0.6 |
0.801 |
1 |
0 |
0 |
0.000 |
| 35 |
38 |
|
[ACT]A:609 |
4 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
4 |
3 |
21021 |
45.8 |
0.6 |
0.856 |
0 |
0 |
0 |
0.000 |
| 36 |
39 |
|
[ACT]A:606 |
4 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
7 |
3 |
21021 |
41.4 |
0.4 |
0.771 |
1 |
0 |
0 |
0.000 |
| 37 |
40 |
|
[MG]B:607 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
11 |
5 |
20470 |
38.3 |
-5.7 |
0.000 |
0 |
0 |
0 |
0.011 |
| 38 |
41 |
|
[ACT]A:610 |
4 |
1 |
183 |
◊ |
B |
x,y,z |
1_555 |
4 |
2 |
20470 |
36.5 |
0.2 |
0.796 |
0 |
0 |
0 |
0.000 |
| 39 |
42 |
|
[ACT]A:610 |
4 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
2 |
1 |
21021 |
36.3 |
1.0 |
0.885 |
2 |
0 |
0 |
0.000 |
| 40 |
43 |
|
[FE]B:602 |
1 |
1 |
137 |
f |
B |
x,y,z |
1_555 |
12 |
5 |
20470 |
36.1 |
-3.8 |
0.000 |
0 |
0 |
0 |
0.011 |
44 |
|
[FE]A:601 |
1 |
1 |
137 |
f |
A |
x,y,z |
1_555 |
10 |
5 |
21021 |
33.0 |
-3.5 |
0.000 |
0 |
0 |
0 |
0.011 |
| Average: |
34.6 |
-3.7 |
0.000 |
0 |
0 |
0 |
0.011 |
| 41 |
45 |
|
B |
4 |
2 |
20470 |
x |
B |
x-1/2,-y+1/2,-z |
4_455 |
3 |
2 |
20470 |
34.9 |
1.0 |
0.883 |
1 |
1 |
0 |
0.000 |
| 42 |
46 |
|
A |
8 |
4 |
21021 |
◊ |
[MG]B:607 |
x-1/2,-y+1/2,-z |
4_455 |
1 |
1 |
98 |
33.9 |
-4.2 |
0.000 |
0 |
0 |
0 |
0.000 |
| 43 |
47 |
|
[MG]B:609 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
3 |
1 |
20470 |
31.2 |
-2.8 |
0.000 |
0 |
0 |
0 |
0.005 |
| 44 |
48 |
|
[ACT]A:605 |
3 |
1 |
184 |
◊ |
B |
x-1,y,z |
1_455 |
2 |
1 |
20470 |
30.2 |
0.7 |
0.904 |
1 |
0 |
0 |
0.000 |
| 45 |
49 |
|
[GOL]A:613 |
5 |
1 |
215 |
◊ |
[CL]B:611 |
-x,y-1/2,-z+1/2 |
3_545 |
1 |
1 |
125 |
29.8 |
-3.5 |
0.000 |
0 |
0 |
0 |
0.000 |
| 46 |
50 |
|
[GOL]A:616 |
3 |
1 |
215 |
f |
[QTT]A:602 |
x,y,z |
1_555 |
2 |
1 |
554 |
22.8 |
0.7 |
0.645 |
0 |
0 |
0 |
0.000 |
| 47 |
51 |
|
[GOL]A:616 |
2 |
1 |
215 |
f |
[ACT]A:603 |
x,y,z |
1_555 |
3 |
1 |
184 |
19.1 |
-0.2 |
0.498 |
0 |
0 |
0 |
0.000 |
| 48 |
52 |
|
[ACT]A:603 |
1 |
1 |
184 |
◊ |
B |
-x,y-1/2,-z+1/2 |
3_545 |
4 |
2 |
20470 |
15.1 |
-0.5 |
0.434 |
0 |
0 |
0 |
0.000 |
| 49 |
53 |
|
[MG]A:617 |
1 |
1 |
98 |
f |
[GOL]A:612 |
x,y,z |
1_555 |
3 |
1 |
214 |
14.2 |
-1.4 |
0.000 |
0 |
0 |
0 |
0.004 |
| 50 |
54 |
|
[GOL]A:616 |
4 |
1 |
215 |
f |
[GOL]A:614 |
x,y,z |
1_555 |
3 |
1 |
220 |
11.9 |
0.1 |
0.554 |
0 |
0 |
0 |
0.000 |
| 51 |
55 |
|
A |
4 |
1 |
21021 |
◊ |
[CL]B:611 |
-x,y-1/2,-z+1/2 |
3_545 |
1 |
1 |
125 |
8.8 |
-0.7 |
0.000 |
0 |
0 |
0 |
0.000 |
| 52 |
56 |
|
[CL]B:611 |
1 |
1 |
125 |
◊ |
A |
x,y,z |
1_555 |
3 |
1 |
21021 |
8.6 |
-0.8 |
0.000 |
0 |
0 |
0 |
0.000 |
| 53 |
57 |
|
[MG]B:609 |
1 |
1 |
98 |
◊ |
A |
-x+1/2,-y,z-1/2 |
2_554 |
1 |
1 |
21021 |
5.1 |
-0.5 |
0.000 |
0 |
0 |
0 |
0.000 |
| 54 |
58 |
|
[GOL]A:614 |
1 |
1 |
220 |
f |
[QTT]A:602 |
x,y,z |
1_555 |
1 |
1 |
554 |
2.2 |
0.1 |
0.500 |
0 |
0 |
0 |
0.000 |
| 55 |
59 |
|
[QTT]A:602 |
1 |
1 |
554 |
◊ |
B |
-x,y-1/2,-z+1/2 |
3_545 |
1 |
1 |
20470 |
1.3 |
0.0 |
0.599 |
0 |
0 |
0 |
0.000 |
| 56 |
60 |
|
A |
1 |
1 |
21021 |
◊ |
[GOL]A:612 |
-x,y-1/2,-z+1/2 |
3_545 |
1 |
1 |
214 |
1.2 |
0.0 |
0.594 |
0 |
0 |
0 |
0.000 |
|