linbc20 commited on 9 days ago

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fd6bcc0

verified ·

1 Parent(s): bb33e0d

Add batch 1

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Files changed (30) hide show

5zjy/5zjy_af2_apo_protein.pdb +0 -0
5zjy/5zjy_af2_holo_ligand.sdf +241 -0
5zjy/5zjy_af2_holo_protein.pdb +0 -0
5zjz/5zjz_af2_apo_protein.pdb +0 -0
5zjz/5zjz_af2_holo_ligand.sdf +271 -0
5zjz/5zjz_af2_holo_protein.pdb +0 -0
5zk5/5zk5_af2_apo_protein.pdb +0 -0
5zk5/5zk5_af2_holo_ligand.sdf +246 -0
5zk5/5zk5_af2_holo_protein.pdb +0 -0
5zk7/5zk7_af2_apo_protein.pdb +0 -0
5zk7/5zk7_af2_holo_ligand.sdf +92 -0
5zk7/5zk7_af2_holo_protein.pdb +0 -0
5zk9/5zk9_af2_apo_protein.pdb +0 -0
5zk9/5zk9_af2_holo_ligand.sdf +248 -0
5zk9/5zk9_af2_holo_protein.pdb +0 -0
5zlf/5zlf_af2_apo_protein.pdb +0 -0
5zlf/5zlf_af2_holo_ligand.sdf +69 -0
5zlf/5zlf_af2_holo_protein.pdb +0 -0
5zml/5zml_af2_apo_protein.pdb +0 -0
5zml/5zml_af2_holo_ligand.sdf +273 -0
5zml/5zml_af2_holo_protein.pdb +0 -0
5zr3/5zr3_af2_apo_protein.pdb +0 -0
5zr3/5zr3_af2_holo_ligand.sdf +76 -0
5zr3/5zr3_af2_holo_protein.pdb +0 -0
5zxk/5zxk_af2_apo_protein.pdb +0 -0
5zxk/5zxk_af2_holo_ligand.sdf +35 -0
5zxk/5zxk_af2_holo_protein.pdb +0 -0
6a1c/6a1c_af2_apo_protein.pdb +0 -0
6a1c/6a1c_af2_holo_ligand.sdf +58 -0
6a1c/6a1c_af2_holo_protein.pdb +0 -0

5zjy/5zjy_af2_apo_protein.pdb ADDED Viewed

The diff for this file is too large to render. See raw diff

5zjy/5zjy_af2_holo_ligand.sdf ADDED Viewed

	@@ -0,0 +1,241 @@

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+M  CHG  2  10   1  19   1
+M  END
+$$$$

5zjy/5zjy_af2_holo_protein.pdb ADDED Viewed

The diff for this file is too large to render. See raw diff

5zjz/5zjz_af2_apo_protein.pdb ADDED Viewed

The diff for this file is too large to render. See raw diff

5zjz/5zjz_af2_holo_ligand.sdf ADDED Viewed

	@@ -0,0 +1,271 @@

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+M  CHG  4  10   1  19   1  30   1  59   1
+M  END
+$$$$

5zjz/5zjz_af2_holo_protein.pdb ADDED Viewed

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5zk5/5zk5_af2_apo_protein.pdb ADDED Viewed

The diff for this file is too large to render. See raw diff

5zk5/5zk5_af2_holo_ligand.sdf ADDED Viewed

	@@ -0,0 +1,246 @@

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+M  CHG  1  86   1
+M  END
+$$$$

5zk5/5zk5_af2_holo_protein.pdb ADDED Viewed

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5zk7/5zk7_af2_apo_protein.pdb ADDED Viewed

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5zk7/5zk7_af2_holo_ligand.sdf ADDED Viewed

	@@ -0,0 +1,92 @@

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+M  END
+$$$$

5zk7/5zk7_af2_holo_protein.pdb ADDED Viewed

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5zk9/5zk9_af2_apo_protein.pdb ADDED Viewed

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5zk9/5zk9_af2_holo_ligand.sdf ADDED Viewed

	@@ -0,0 +1,248 @@

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+M  CHG  1  85   1
+M  END
+$$$$

5zk9/5zk9_af2_holo_protein.pdb ADDED Viewed

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5zlf/5zlf_af2_apo_protein.pdb ADDED Viewed

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5zlf/5zlf_af2_holo_ligand.sdf ADDED Viewed

	@@ -0,0 +1,69 @@

+     RDKit          3D
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+M  END
+$$$$

5zlf/5zlf_af2_holo_protein.pdb ADDED Viewed

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5zml/5zml_af2_apo_protein.pdb ADDED Viewed

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5zml/5zml_af2_holo_ligand.sdf ADDED Viewed

	@@ -0,0 +1,273 @@

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+M  CHG  2  10   1  19   1
+M  END
+$$$$

5zml/5zml_af2_holo_protein.pdb ADDED Viewed

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5zr3/5zr3_af2_apo_protein.pdb ADDED Viewed

The diff for this file is too large to render. See raw diff

5zr3/5zr3_af2_holo_ligand.sdf ADDED Viewed

	@@ -0,0 +1,76 @@

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+  3  2  2  0
+  2  1  1  0
+  2 10  1  0
+  8  9  1  0
+  9 10  2  0
+ 10 11  1  0
+ 11 12  1  0
+ 11 33  1  0
+ 12 13  2  0
+ 13 14  1  0
+ 13 17  1  0
+ 14 15  1  0
+ 14 16  1  0
+ 17 33  2  0
+ 17 18  1  0
+ 33 32  1  0
+ 32 31  2  0
+ 31 30  1  0
+ 30 18  2  0
+ 18 19  1  0
+ 19 20  1  0
+ 19 29  1  0
+ 20 21  2  0
+ 21 22  1  0
+ 29 22  2  0
+ 22 23  1  0
+ 23 24  1  0
+ 23 28  2  0
+ 24 25  2  0
+ 25 26  1  0
+ 28 26  1  0
+ 26 27  1  0
+M  END
+$$$$

5zr3/5zr3_af2_holo_protein.pdb ADDED Viewed

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5zxk/5zxk_af2_apo_protein.pdb ADDED Viewed

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5zxk/5zxk_af2_holo_ligand.sdf ADDED Viewed

	@@ -0,0 +1,35 @@

+     RDKit          3D
+ 15 14  0  0  0  0  0  0  0  0999 V2000
+  -51.2321  -30.8729   58.4208 C   0  0  0  0  0  0  0  0  0  0  0  0
+  -51.9817  -29.6910   57.9114 C   0  0  0  0  0  0  0  0  0  0  0  0
+  -52.2243  -28.5878   58.6218 C   0  0  0  0  0  0  0  0  0  0  0  0
+  -51.7116  -28.2346   59.9757 C   0  0  0  0  0  0  0  0  0  0  0  0
+  -50.6085  -27.2997   59.8939 O   0  0  0  0  0  0  0  0  0  0  0  0
+  -49.7637  -27.0072   61.2286 P   0  0  0  0  0  0  0  0  0  0  0  0
+  -49.3683  -28.2719   61.9200 O   0  0  0  0  0  0  0  0  0  0  0  0
+  -48.7033  -26.0609   60.7565 O   0  0  0  0  0  0  0  0  0  0  0  0
+  -50.8826  -26.2781   62.1455 O   0  0  0  0  0  0  0  0  0  0  0  0
+  -51.9082  -24.9915   62.0583 P   0  0  0  0  0  0  0  0  0  0  0  0
+  -51.6475  -24.4421   60.6600 O   0  0  0  0  0  0  0  0  0  0  0  0
+  -51.4809  -24.1021   63.2312 O   0  0  0  0  0  0  0  0  0  0  0  0
+  -53.3665  -25.4668   62.2268 O   0  0  0  0  0  0  0  0  0  0  0  0
+  -52.5045  -29.7766   56.4396 C   0  0  0  0  0  0  0  0  0  0  0  0
+  -52.8697  -28.5005   55.9143 O   0  0  0  0  0  0  0  0  0  0  0  0
+  6  8  1  0
+  6  7  2  0
+  6  9  1  0
+  5  6  1  0
+  9 10  1  0
+ 10 12  1  0
+ 10 11  2  0
+ 10 13  1  0
+  2  1  1  0
+  4  3  1  0
+  3  2  2  0
+  4  5  1  0
+  2 14  1  0
+ 14 15  1  0
+M  END
+$$$$

5zxk/5zxk_af2_holo_protein.pdb ADDED Viewed

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6a1c/6a1c_af2_apo_protein.pdb ADDED Viewed

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6a1c/6a1c_af2_holo_ligand.sdf ADDED Viewed

	@@ -0,0 +1,58 @@

+     RDKit          3D
+ 25 27  0  0  0  0  0  0  0  0999 V2000
+    6.5919    6.3457   -5.4775 C   0  0  0  0  0  0  0  0  0  0  0  0
+    5.8548    6.1270   -6.6815 O   0  0  0  0  0  0  0  0  0  0  0  0
+    5.4764    7.1662   -7.5054 C   0  0  0  0  0  0  0  0  0  0  0  0
+    5.7088    8.4838   -7.1285 C   0  0  0  0  0  0  0  0  0  0  0  0
+    5.3423    9.5280   -7.9688 C   0  0  0  0  0  0  0  0  0  0  0  0
+    5.6153   10.9010   -7.4822 C   0  0  0  0  0  0  0  0  0  0  0  0
+    5.7741   11.1155   -6.2474 N   0  0  0  0  0  0  0  0  0  0  0  0
+    5.7970   12.3424   -5.6925 N   0  0  0  0  0  0  0  0  0  0  0  0
+    5.3691   13.4605   -6.3148 C   0  0  0  0  0  0  0  0  0  0  0  0
+    4.7075   13.5459   -7.9363 S   0  0  0  0  0  0  0  0  0  0  0  0
+    4.8295   15.2265   -8.5207 C   0  0  0  0  0  0  0  0  0  0  0  0
+    5.4976   14.5613   -5.5476 N   0  0  0  0  0  0  0  0  0  0  0  0
+    6.0614   14.0540   -4.3458 N   0  0  0  0  0  0  0  0  0  0  0  0
+    6.2550   12.6826   -4.4331 C   0  0  0  0  0  0  0  0  0  0  0  0
+    6.8894   11.8764   -3.3115 C   0  0  0  0  0  0  0  0  0  0  0  0
+    7.3600   10.5502   -3.4731 C   0  0  0  0  0  0  0  0  0  0  0  0
+    7.9715    9.8280   -2.4148 C   0  0  0  0  0  0  0  0  0  0  0  0
+    8.1343   10.4612   -1.1882 C   0  0  0  0  0  0  0  0  0  0  0  0
+    7.6998   11.7769   -1.0148 C   0  0  0  0  0  0  0  0  0  0  0  0
+    7.1015   12.4910   -2.0672 C   0  0  0  0  0  0  0  0  0  0  0  0
+    4.7706    9.1825   -9.2087 C   0  0  0  0  0  0  0  0  0  0  0  0
+    4.2717   10.4516  -10.4032 Br  0  0  0  0  0  0  0  0  0  0  0  0
+    4.5415    7.9094   -9.6463 C   0  0  0  0  0  0  0  0  0  0  0  0
+    4.8906    6.9140   -8.7550 C   0  0  0  0  0  0  0  0  0  0  0  0
+    4.6351    5.7300   -9.1507 O   0  0  0  0  0  0  0  0  0  0  0  0
+ 23 24  1  0
+  3 24  1  0
+ 24 25  2  0
+ 21 23  2  0
+  5 21  1  0
+ 21 22  1  0
+  5  4  2  0
+  6  5  1  0
+  4  3  1  0
+  3  2  1  0
+  2  1  1  0
+  7  6  2  0
+  8  9  1  0
+  9 12  2  0
+  9 10  1  0
+  7  8  1  0
+  8 14  1  0
+ 14 13  2  0
+ 14 15  1  0
+ 13 12  1  0
+ 10 11  1  0
+ 15 16  2  0
+ 15 20  1  0
+ 16 17  1  0
+ 17 18  2  0
+ 18 19  1  0
+ 19 20  2  0
+M  END
+$$$$

6a1c/6a1c_af2_holo_protein.pdb ADDED Viewed

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