## |
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 |
41 |
15 |
14038 |
◊ |
B |
-x+1,y,-z+5/2 |
3_657 |
44 |
15 |
13966 |
467.6 |
-9.4 |
0.041 |
4 |
0 |
0 |
0.020 |
2 |
|
C |
40 |
13 |
14072 |
◊ |
A |
-x,y,-z+5/2 |
3_557 |
43 |
15 |
14154 |
434.1 |
-9.6 |
0.031 |
4 |
0 |
0 |
0.020 |
Average: |
450.8 |
-9.5 |
0.036 |
4 |
0 |
0 |
0.020 |
2 |
3 |
|
[OK3]D:401 |
25 |
1 |
530 |
cf |
D |
x,y,z |
1_555 |
53 |
19 |
14038 |
345.9 |
-4.5 |
0.628 |
8 |
0 |
0 |
0.074 |
4 |
|
[OK3]C:401 |
25 |
1 |
532 |
cf |
C |
x,y,z |
1_555 |
49 |
19 |
14072 |
345.2 |
-4.5 |
0.646 |
8 |
0 |
0 |
0.074 |
5 |
|
[OK3]A:401 |
25 |
1 |
536 |
cf |
A |
x,y,z |
1_555 |
51 |
19 |
14154 |
344.5 |
-5.1 |
0.628 |
10 |
0 |
0 |
0.074 |
6 |
|
[OK3]B:401 |
25 |
1 |
533 |
cf |
B |
x,y,z |
1_555 |
50 |
18 |
13966 |
340.0 |
-5.5 |
0.611 |
9 |
0 |
0 |
0.074 |
Average: |
343.9 |
-4.9 |
0.628 |
9 |
0 |
0 |
0.074 |
3 |
7 |
|
C |
31 |
9 |
14072 |
◊ |
A |
x,y,z |
1_555 |
28 |
9 |
14154 |
310.3 |
4.1 |
0.981 |
13 |
0 |
0 |
0.000 |
8 |
|
D |
28 |
8 |
14038 |
◊ |
B |
x,y,z |
1_555 |
29 |
9 |
13966 |
307.2 |
4.0 |
0.979 |
13 |
0 |
0 |
0.000 |
Average: |
308.8 |
4.0 |
0.980 |
13 |
0 |
0 |
0.000 |
4 |
9 |
|
B |
29 |
10 |
13966 |
◊ |
A |
x,y,z |
1_555 |
23 |
7 |
14154 |
276.7 |
-4.4 |
0.117 |
2 |
0 |
0 |
0.000 |
10 |
|
D |
31 |
8 |
14038 |
◊ |
D |
x,-y,-z+2 |
4_557 |
31 |
8 |
14038 |
272.9 |
-5.0 |
0.208 |
2 |
0 |
0 |
0.000 |
Average: |
274.8 |
-4.7 |
0.162 |
2 |
0 |
0 |
0.000 |
5 |
11 |
|
C |
29 |
9 |
14072 |
◊ |
B |
-x+1,y,-z+5/2 |
3_657 |
27 |
9 |
13966 |
263.1 |
-0.1 |
0.655 |
5 |
0 |
0 |
0.000 |
6 |
12 |
|
C |
22 |
9 |
14072 |
◊ |
C |
x,-y+1,-z+3 |
4_568 |
22 |
9 |
14072 |
237.8 |
-1.3 |
0.588 |
4 |
0 |
0 |
0.000 |
7 |
13 |
|
[EPE]D:403 |
15 |
1 |
407 |
◊ |
D |
x,y,z |
1_555 |
28 |
11 |
14038 |
212.7 |
3.8 |
0.064 |
5 |
0 |
0 |
0.000 |
8 |
14 |
|
[EPE]A:403 |
15 |
1 |
404 |
◊ |
A |
x,y,z |
1_555 |
30 |
12 |
14154 |
212.4 |
3.8 |
0.083 |
5 |
0 |
0 |
0.000 |
9 |
15 |
|
D |
22 |
7 |
14038 |
◊ |
A |
x,y,z |
1_555 |
25 |
6 |
14154 |
198.7 |
-0.6 |
0.701 |
7 |
0 |
0 |
0.000 |
10 |
16 |
|
D |
13 |
6 |
14038 |
◊ |
A |
-x,y,-z+5/2 |
3_557 |
21 |
10 |
14154 |
169.8 |
-0.6 |
0.606 |
3 |
0 |
0 |
0.000 |
11 |
17 |
|
A |
15 |
4 |
14154 |
◊ |
C |
-x,-y+1,z-1/2 |
2_564 |
17 |
7 |
14072 |
165.6 |
-0.4 |
0.667 |
3 |
2 |
0 |
0.000 |
12 |
18 |
|
[MPD]A:402 |
7 |
1 |
276 |
f |
A |
x,y,z |
1_555 |
27 |
9 |
14154 |
162.4 |
-9.7 |
0.842 |
0 |
0 |
0 |
0.029 |
13 |
19 |
|
A |
18 |
5 |
14154 |
◊ |
A |
-x,y,-z+3/2 |
3_556 |
18 |
5 |
14154 |
143.7 |
1.3 |
0.889 |
2 |
0 |
0 |
0.000 |
14 |
20 |
|
C |
13 |
5 |
14072 |
◊ |
A |
x,-y+1,-z+2 |
4_567 |
14 |
5 |
14154 |
139.3 |
-0.1 |
0.661 |
2 |
0 |
0 |
0.000 |
15 |
21 |
|
[GOL]B:403 |
6 |
1 |
217 |
◊ |
B |
x,y,z |
1_555 |
28 |
9 |
13966 |
139.0 |
-0.0 |
0.713 |
1 |
0 |
0 |
0.000 |
16 |
22 |
|
[GOL]C:403 |
6 |
1 |
218 |
f |
C |
x,y,z |
1_555 |
25 |
10 |
14072 |
136.5 |
-0.5 |
0.580 |
3 |
0 |
0 |
0.016 |
17 |
23 |
|
[GOL]C:404 |
6 |
1 |
217 |
f |
C |
x,y,z |
1_555 |
24 |
9 |
14072 |
133.8 |
-0.6 |
0.559 |
1 |
0 |
0 |
0.010 |
18 |
24 |
|
B |
15 |
5 |
13966 |
◊ |
B |
-x+1,y,-z+3/2 |
3_656 |
14 |
5 |
13966 |
131.2 |
-2.0 |
0.360 |
0 |
0 |
0 |
0.000 |
19 |
25 |
|
B |
18 |
8 |
13966 |
◊ |
D |
-x+1,-y,z-1/2 |
2_654 |
11 |
5 |
14038 |
117.7 |
1.1 |
0.747 |
3 |
0 |
0 |
0.000 |
20 |
26 |
|
A |
10 |
5 |
14154 |
◊ |
A |
-x,y,-z+5/2 |
3_557 |
10 |
5 |
14154 |
110.7 |
2.1 |
0.949 |
4 |
0 |
0 |
0.000 |
27 |
|
D |
8 |
4 |
14038 |
◊ |
D |
-x+1,y,-z+5/2 |
3_657 |
8 |
4 |
14038 |
73.0 |
0.3 |
0.761 |
0 |
0 |
0 |
0.000 |
Average: |
91.9 |
1.2 |
0.855 |
2 |
0 |
0 |
0.000 |
21 |
28 |
|
[MPD]D:402 |
7 |
1 |
278 |
f |
D |
x,y,z |
1_555 |
18 |
6 |
14038 |
101.2 |
-6.3 |
0.714 |
0 |
0 |
0 |
0.023 |
22 |
29 |
|
[EPE]A:403 |
7 |
1 |
404 |
f |
C |
-x,y,-z+5/2 |
3_557 |
10 |
4 |
14072 |
99.9 |
1.5 |
0.109 |
0 |
0 |
0 |
0.000 |
23 |
30 |
|
[EPE]D:403 |
10 |
1 |
407 |
f |
B |
-x+1,y,-z+5/2 |
3_657 |
10 |
4 |
13966 |
99.9 |
1.4 |
0.025 |
0 |
0 |
0 |
0.000 |
24 |
31 |
|
D |
12 |
3 |
14038 |
◊ |
D |
-x,y,-z+5/2 |
3_557 |
12 |
3 |
14038 |
98.1 |
-0.5 |
0.615 |
0 |
0 |
0 |
0.000 |
25 |
32 |
|
[MPD]B:402 |
5 |
1 |
272 |
f |
D |
x,y,z |
1_555 |
12 |
5 |
14038 |
94.5 |
-5.2 |
0.820 |
0 |
0 |
0 |
0.019 |
26 |
33 |
|
C |
8 |
4 |
14072 |
◊ |
C |
-x,y,-z+5/2 |
3_557 |
8 |
4 |
14072 |
83.1 |
2.8 |
0.979 |
4 |
0 |
0 |
0.000 |
34 |
|
B |
6 |
3 |
13966 |
◊ |
B |
-x+1,y,-z+5/2 |
3_657 |
6 |
3 |
13966 |
42.5 |
1.1 |
0.906 |
0 |
0 |
0 |
0.000 |
Average: |
62.8 |
2.0 |
0.942 |
2 |
0 |
0 |
0.000 |
27 |
35 |
|
[MPD]B:402 |
6 |
1 |
272 |
◊ |
B |
x,y,z |
1_555 |
15 |
4 |
13966 |
78.5 |
-4.3 |
0.827 |
1 |
0 |
0 |
0.000 |
28 |
36 |
|
[CL]B:404 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
11 |
5 |
13966 |
74.5 |
-10.9 |
0.000 |
0 |
0 |
0 |
0.057 |
29 |
37 |
|
[GOL]C:402 |
5 |
1 |
216 |
f |
C |
x,y,z |
1_555 |
15 |
4 |
14072 |
74.3 |
-0.5 |
0.554 |
2 |
0 |
0 |
0.013 |
30 |
38 |
|
[GOL]C:402 |
5 |
1 |
216 |
◊ |
A |
x,y,z |
1_555 |
14 |
5 |
14154 |
70.2 |
-0.5 |
0.553 |
0 |
0 |
0 |
0.000 |
31 |
39 |
|
[CL]A:405 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
12 |
5 |
14154 |
56.5 |
-7.7 |
0.000 |
0 |
0 |
0 |
0.026 |
40 |
|
[CL]D:404 |
1 |
1 |
125 |
f |
D |
x,y,z |
1_555 |
12 |
5 |
14038 |
56.1 |
-7.3 |
0.000 |
0 |
0 |
0 |
0.026 |
Average: |
56.3 |
-7.5 |
0.000 |
0 |
0 |
0 |
0.026 |
32 |
41 |
|
[NA]A:404 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
8 |
5 |
14154 |
52.1 |
-6.7 |
0.000 |
0 |
0 |
0 |
0.020 |
33 |
42 |
|
[NA]A:404 |
1 |
1 |
125 |
◊ |
C |
-x,y,-z+5/2 |
3_557 |
4 |
2 |
14072 |
25.1 |
-2.9 |
0.000 |
0 |
0 |
0 |
0.005 |
34 |
43 |
|
[GOL]B:403 |
2 |
1 |
217 |
f |
[MPD]B:402 |
x,y,z |
1_555 |
4 |
1 |
272 |
14.2 |
-0.9 |
0.000 |
0 |
0 |
0 |
0.003 |
35 |
44 |
|
[GOL]C:404 |
1 |
1 |
217 |
f |
[GOL]C:402 |
x,y,z |
1_555 |
2 |
1 |
216 |
7.1 |
-0.0 |
0.565 |
0 |
0 |
0 |
0.000 |
|