| ## |
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 |
|
[TPP]X:100 |
24 |
1 |
599 |
f |
X |
x,y,z |
1_555 |
58 |
18 |
12042 |
369.9 |
-7.8 |
0.760 |
4 |
0 |
0 |
0.027 |
| 2 |
2 |
|
[TPP]Y:100 |
25 |
1 |
603 |
f |
Y |
x,y,z |
1_555 |
56 |
18 |
12315 |
361.8 |
-6.8 |
0.813 |
4 |
0 |
0 |
0.203 |
| 3 |
3 |
|
X |
45 |
16 |
12042 |
◊ |
X |
-x,y,-z |
2_555 |
43 |
16 |
12042 |
339.6 |
-14.5 |
0.638 |
0 |
0 |
0 |
0.020 |
| 4 |
4 |
|
X |
41 |
11 |
12042 |
◊ |
Y |
-x,y-1,-z+1 |
2_546 |
49 |
8 |
12315 |
317.4 |
-8.4 |
0.829 |
0 |
0 |
0 |
0.000 |
| 5 |
5 |
|
Y |
35 |
8 |
12315 |
◊ |
Y |
-x,y,-z+1 |
2_556 |
35 |
8 |
12315 |
271.4 |
-12.5 |
0.587 |
4 |
0 |
0 |
0.170 |
| 6 |
6 |
|
X |
31 |
5 |
12042 |
◊ |
Y |
x-1/2,y+1/2,z-1 |
3_454 |
31 |
6 |
12315 |
263.5 |
-9.2 |
0.667 |
4 |
0 |
0 |
0.027 |
| 7 |
7 |
|
X |
39 |
12 |
12042 |
x |
X |
x,y-1,z |
1_545 |
39 |
14 |
12042 |
242.1 |
-11.3 |
0.677 |
0 |
0 |
0 |
0.000 |
| 8 |
8 |
|
Y |
19 |
3 |
12315 |
◊ |
X |
x,y,z |
1_555 |
20 |
3 |
12042 |
162.9 |
-0.6 |
0.887 |
6 |
0 |
0 |
0.000 |
| 9 |
9 |
|
[CCC]Y:89 |
15 |
1 |
488 |
cf |
Y |
x,y,z |
1_555 |
21 |
2 |
12315 |
141.0 |
2.1 |
0.713 |
1 |
0 |
0 |
0.000 |
| 10 |
10 |
|
[CCC]X:89 |
16 |
1 |
481 |
cf |
X |
x,y,z |
1_555 |
22 |
2 |
12042 |
138.3 |
2.2 |
0.724 |
0 |
0 |
0 |
0.000 |
| 11 |
11 |
|
[GTP]Y:10 |
16 |
1 |
595 |
cf |
Y |
x,y,z |
1_555 |
20 |
2 |
12315 |
129.3 |
0.7 |
0.806 |
0 |
0 |
0 |
0.000 |
| 12 |
12 |
|
[GTP]X:10 |
17 |
1 |
551 |
cf |
X |
x,y,z |
1_555 |
20 |
2 |
12042 |
126.6 |
1.0 |
0.919 |
0 |
0 |
0 |
0.000 |
| 13 |
13 |
|
X |
16 |
5 |
12042 |
x |
X |
-x-1/2,y-1/2,-z |
4_445 |
16 |
4 |
12042 |
114.4 |
-3.3 |
0.704 |
0 |
0 |
0 |
0.000 |
| 14 |
14 |
|
[K]X:125 |
1 |
1 |
216 |
f |
X |
x,y,z |
1_555 |
14 |
6 |
12042 |
114.2 |
-94.5 |
0.000 |
0 |
0 |
0 |
0.263 |
| 15 |
15 |
|
X |
14 |
4 |
12042 |
◊ |
Y |
x,y-1,z |
1_545 |
14 |
5 |
12315 |
106.8 |
-2.6 |
0.712 |
0 |
0 |
0 |
0.000 |
| 16 |
16 |
|
[K]X:123 |
1 |
1 |
216 |
f |
X |
x,y,z |
1_555 |
17 |
4 |
12042 |
106.6 |
-76.3 |
0.000 |
0 |
0 |
0 |
0.212 |
| 17 |
17 |
|
Y |
15 |
4 |
12315 |
◊ |
X |
-x,y,-z |
2_555 |
14 |
4 |
12042 |
104.8 |
-4.3 |
0.606 |
0 |
0 |
0 |
0.000 |
| 18 |
18 |
|
Y |
17 |
7 |
12315 |
x |
Y |
x,y-1,z |
1_545 |
14 |
6 |
12315 |
104.3 |
-4.1 |
0.649 |
2 |
0 |
0 |
0.000 |
| 19 |
19 |
|
Y |
12 |
5 |
12315 |
x |
Y |
-x+1/2,y-1/2,-z+1 |
4_546 |
16 |
5 |
12315 |
100.8 |
-5.7 |
0.490 |
1 |
0 |
0 |
0.000 |
| 20 |
20 |
|
[GTP]X:10 |
13 |
1 |
551 |
◊ |
[CCC]Y:89 |
x-1/2,y-1/2,z-1 |
3_444 |
12 |
1 |
488 |
100.8 |
0.4 |
0.628 |
1 |
0 |
0 |
0.000 |
21 |
|
[CCC]X:89 |
13 |
1 |
481 |
◊ |
[GTP]Y:10 |
x-1/2,y-1/2,z-1 |
3_444 |
13 |
1 |
595 |
89.7 |
0.7 |
0.538 |
2 |
0 |
0 |
0.000 |
| Average: |
95.2 |
0.6 |
0.583 |
2 |
0 |
0 |
0.000 |
| 21 |
22 |
|
[GTP]X:10 |
17 |
1 |
551 |
◊ |
[GTP]Y:10 |
x-1/2,y-1/2,z-1 |
3_444 |
14 |
1 |
595 |
96.2 |
2.9 |
0.886 |
0 |
0 |
0 |
0.000 |
| 22 |
23 |
|
[K]X:124 |
1 |
1 |
216 |
f |
X |
x,y,z |
1_555 |
9 |
4 |
12042 |
88.9 |
-87.0 |
0.000 |
0 |
0 |
0 |
0.242 |
| 23 |
24 |
|
[CCC]Y:89 |
9 |
1 |
488 |
◊ |
Y |
-x+1/2,y-1/2,-z+1 |
4_546 |
11 |
2 |
12315 |
67.9 |
-0.2 |
0.572 |
0 |
0 |
0 |
0.000 |
| 24 |
25 |
|
[NA]X:122 |
1 |
1 |
125 |
f |
X |
x,y,z |
1_555 |
13 |
7 |
12042 |
67.3 |
-10.5 |
0.000 |
0 |
0 |
0 |
0.029 |
| 25 |
26 |
|
[NA]X:121 |
1 |
1 |
125 |
f |
X |
x,y,z |
1_555 |
12 |
5 |
12042 |
59.4 |
-8.2 |
0.000 |
0 |
0 |
0 |
0.023 |
| 26 |
27 |
|
[CCC]Y:89 |
4 |
1 |
488 |
f |
[GTP]Y:10 |
x,y,z |
1_555 |
4 |
1 |
595 |
56.0 |
1.0 |
0.540 |
3 |
0 |
0 |
0.009 |
28 |
|
[CCC]X:89 |
4 |
1 |
481 |
f |
[GTP]X:10 |
x,y,z |
1_555 |
4 |
1 |
551 |
55.0 |
0.9 |
0.577 |
3 |
0 |
0 |
0.009 |
| Average: |
55.5 |
0.9 |
0.558 |
3 |
0 |
0 |
0.009 |
| 27 |
29 |
|
[CCC]X:89 |
3 |
1 |
481 |
◊ |
Y |
x-1/2,y+1/2,z-1 |
3_454 |
8 |
2 |
12315 |
46.9 |
-1.5 |
0.340 |
0 |
0 |
0 |
0.004 |
| 28 |
30 |
|
X |
8 |
2 |
12042 |
◊ |
[CCC]Y:89 |
x-1/2,y+1/2,z-1 |
3_454 |
4 |
1 |
488 |
45.8 |
-1.5 |
0.333 |
0 |
0 |
0 |
0.004 |
| 29 |
31 |
|
[MG]X:101 |
1 |
1 |
98 |
f |
X |
x,y,z |
1_555 |
10 |
6 |
12042 |
45.2 |
-7.3 |
0.000 |
0 |
0 |
0 |
0.171 |
32 |
|
[MG]Y:111 |
1 |
1 |
98 |
f |
Y |
x,y,z |
1_555 |
10 |
6 |
12315 |
44.3 |
-7.2 |
0.000 |
0 |
0 |
0 |
0.171 |
| Average: |
44.8 |
-7.3 |
0.000 |
0 |
0 |
0 |
0.171 |
| 30 |
33 |
|
[MG]X:103 |
1 |
1 |
98 |
f |
X |
x,y,z |
1_555 |
10 |
5 |
12042 |
43.1 |
-5.4 |
0.000 |
0 |
0 |
0 |
0.118 |
34 |
|
[MG]Y:113 |
1 |
1 |
98 |
f |
Y |
x,y,z |
1_555 |
9 |
5 |
12315 |
40.2 |
-5.0 |
0.000 |
0 |
0 |
0 |
0.118 |
| Average: |
41.7 |
-5.2 |
0.000 |
0 |
0 |
0 |
0.118 |
| 31 |
35 |
|
[MG]X:102 |
1 |
1 |
98 |
f |
X |
x,y,z |
1_555 |
8 |
3 |
12042 |
42.0 |
-5.4 |
0.000 |
0 |
0 |
0 |
0.097 |
36 |
|
[MG]Y:112 |
1 |
1 |
98 |
f |
Y |
x,y,z |
1_555 |
7 |
3 |
12315 |
36.2 |
-4.1 |
0.000 |
0 |
0 |
0 |
0.097 |
| Average: |
39.1 |
-4.7 |
0.000 |
0 |
0 |
0 |
0.097 |
| 32 |
37 |
|
[TPP]Y:100 |
6 |
1 |
603 |
f |
[MG]Y:112 |
x,y,z |
1_555 |
1 |
1 |
98 |
41.4 |
-6.9 |
0.000 |
0 |
0 |
0 |
0.164 |
38 |
|
[TPP]X:100 |
4 |
1 |
599 |
f |
[MG]X:102 |
x,y,z |
1_555 |
1 |
1 |
98 |
40.5 |
-6.7 |
0.000 |
0 |
0 |
0 |
0.164 |
| Average: |
41.0 |
-6.8 |
0.000 |
0 |
0 |
0 |
0.164 |
| 33 |
39 |
|
[K]X:124 |
1 |
1 |
216 |
f |
[K]X:123 |
x,y,z |
1_555 |
1 |
1 |
216 |
31.3 |
-31.3 |
0.000 |
0 |
0 |
0 |
0.087 |
| 34 |
40 |
|
[TPP]Y:100 |
4 |
1 |
603 |
f |
[MG]Y:111 |
x,y,z |
1_555 |
1 |
1 |
98 |
30.2 |
-4.6 |
0.000 |
0 |
0 |
0 |
0.108 |
41 |
|
[TPP]X:100 |
3 |
1 |
599 |
f |
[MG]X:101 |
x,y,z |
1_555 |
1 |
1 |
98 |
30.0 |
-4.6 |
0.000 |
0 |
0 |
0 |
0.108 |
| Average: |
30.1 |
-4.6 |
0.000 |
0 |
0 |
0 |
0.108 |
| 35 |
42 |
|
[GTP]X:10 |
1 |
1 |
551 |
◊ |
Y |
x-1/2,y-1/2,z-1 |
3_444 |
3 |
1 |
12315 |
25.1 |
-1.6 |
0.351 |
0 |
0 |
0 |
0.000 |
| 36 |
43 |
|
[CCC]X:89 |
3 |
1 |
481 |
◊ |
Y |
-x,y,-z |
2_555 |
2 |
1 |
12315 |
23.9 |
-1.0 |
0.316 |
0 |
0 |
0 |
0.000 |
| 37 |
44 |
|
X |
3 |
1 |
12042 |
◊ |
[GTP]Y:10 |
x-1/2,y-1/2,z-1 |
3_444 |
4 |
1 |
595 |
20.7 |
-1.0 |
0.428 |
0 |
0 |
0 |
0.000 |
| 38 |
45 |
|
[TPP]X:100 |
3 |
1 |
599 |
f |
[K]X:124 |
x,y,z |
1_555 |
1 |
1 |
216 |
14.1 |
-5.7 |
0.000 |
0 |
0 |
0 |
0.016 |
| 39 |
46 |
|
X |
1 |
1 |
12042 |
◊ |
Y |
-x,y-2,-z+1 |
2_536 |
1 |
1 |
12315 |
10.2 |
-1.1 |
0.205 |
0 |
0 |
0 |
0.000 |
| 40 |
47 |
|
Y |
1 |
1 |
12315 |
x |
Y |
-x,y-1,-z+1 |
2_546 |
1 |
1 |
12315 |
9.9 |
-1.1 |
0.207 |
0 |
0 |
0 |
0.000 |
| 41 |
48 |
|
[TPP]X:100 |
1 |
1 |
599 |
f |
[MG]X:103 |
x,y,z |
1_555 |
1 |
1 |
98 |
3.2 |
-0.2 |
0.000 |
0 |
0 |
0 |
0.004 |
49 |
|
[TPP]Y:100 |
1 |
1 |
603 |
f |
[MG]Y:113 |
x,y,z |
1_555 |
1 |
1 |
98 |
2.5 |
-0.2 |
0.000 |
0 |
0 |
0 |
0.004 |
| Average: |
2.8 |
-0.2 |
0.000 |
0 |
0 |
0 |
0.004 |
| 42 |
50 |
|
X |
1 |
1 |
12042 |
◊ |
[CCC]Y:89 |
x-1/2,y-1/2,z-1 |
3_444 |
1 |
1 |
488 |
3.1 |
0.1 |
0.481 |
0 |
0 |
0 |
0.000 |
| 43 |
51 |
|
[MG]Y:112 |
1 |
1 |
98 |
f |
[MG]Y:111 |
x,y,z |
1_555 |
1 |
1 |
98 |
2.3 |
-0.5 |
0.000 |
0 |
0 |
0 |
0.011 |
| 44 |
52 |
|
[K]X:125 |
1 |
1 |
216 |
f |
[K]X:124 |
x,y,z |
1_555 |
1 |
1 |
216 |
1.9 |
-1.9 |
0.000 |
0 |
0 |
0 |
0.005 |
| 45 |
53 |
|
X |
1 |
1 |
12042 |
◊ |
Y |
x-1/2,y-1/2,z-1 |
3_444 |
1 |
1 |
12315 |
1.1 |
-0.1 |
0.343 |
0 |
0 |
0 |
0.000 |
|