5G4X

The crystal structure of the SHANK3 N-terminus

Functional Information from PDB Data

site_id	AC1
Number of Residues	6
Details	BINDING SITE FOR RESIDUE EDO A 1348

Chain	Residue
A	SER148
A	GLY149
A	THR180
A	ARG181
A	ASP182
A	HOH2108

---

site_id	AC2
Number of Residues	5
Details	BINDING SITE FOR RESIDUE EDO A 1349

Chain	Residue
A	ASN284
A	HOH2254
A	TRP251
A	ASN280
A	SER282

---

site_id	AC3
Number of Residues	6
Details	BINDING SITE FOR RESIDUE EDO A 1350

Chain	Residue
A	PHE56
A	ARG91
A	ARG94
A	ARG95
A	HOH2056
A	HOH2060

---

site_id	AC4
Number of Residues	4
Details	BINDING SITE FOR RESIDUE EDO A 1351

Chain	Residue
A	GLU267
A	ARG305
A	HOH2189
A	HOH2192

---

site_id	AC5
Number of Residues	2
Details	BINDING SITE FOR RESIDUE EDO A 1352

Chain	Residue
A	PHE271
A	ARG347

---

site_id	AC6
Number of Residues	4
Details	BINDING SITE FOR RESIDUE EDO A 1353

Chain	Residue
A	GLN279
A	VAL311
A	ARG312
A	EDO1376

---

site_id	AC7
Number of Residues	9
Details	BINDING SITE FOR RESIDUE EDO A 1354

Chain	Residue
A	ASP17
A	TYR53
A	ARG91
A	TYR92
A	ARG94
A	HOH2004
A	HOH2007
A	HOH2056
A	HOH2255

---

site_id	AC8
Number of Residues	2
Details	BINDING SITE FOR RESIDUE EDO A 1355

Chain	Residue
A	ASP136
A	VAL168

---

site_id	AC9
Number of Residues	4
Details	BINDING SITE FOR RESIDUE EDO A 1356

Chain	Residue
A	GLN158
A	LEU184
A	ARG192
A	GLN193

---

site_id	BC1
Number of Residues	7
Details	BINDING SITE FOR RESIDUE EDO A 1357

Chain	Residue
A	PHE67
A	LEU68
A	LYS93
A	HIS175
A	ASP177
A	HOH2042
A	HOH2046

---

site_id	BC2
Number of Residues	3
Details	BINDING SITE FOR RESIDUE EDO A 1358

Chain	Residue
A	GLN252
A	ASN275
A	HOH2205

---

site_id	BC3
Number of Residues	4
Details	BINDING SITE FOR RESIDUE EDO A 1359

Chain	Residue
A	GLY244
A	THR245
A	THR246
A	HOH2150

---

site_id	BC4
Number of Residues	3
Details	BINDING SITE FOR RESIDUE EDO A 1360

Chain	Residue
A	GLN19
A	LEU125
A	SER127

---

site_id	BC5
Number of Residues	3
Details	BINDING SITE FOR RESIDUE EDO A 1361

Chain	Residue
A	LEU85
A	ASP147
A	SER148

---

site_id	BC6
Number of Residues	3
Details	BINDING SITE FOR RESIDUE EDO A 1362

Chain	Residue
A	ARG215
A	ASP247
A	EDO1367

---

site_id	BC7
Number of Residues	4
Details	BINDING SITE FOR RESIDUE EDO A 1363

Chain	Residue
A	ASN294
A	GLY327
A	PHE329
A	GLU330

---

site_id	BC8
Number of Residues	4
Details	BINDING SITE FOR RESIDUE EDO A 1364

Chain	Residue
A	GLU234
A	LEU235
A	HIS238
A	HIS238

---

site_id	BC9
Number of Residues	4
Details	BINDING SITE FOR RESIDUE EDO A 1365

Chain	Residue
A	ASN44
A	SER46
A	PHE329
A	GLU333

---

site_id	CC1
Number of Residues	4
Details	BINDING SITE FOR RESIDUE EDO A 1366

Chain	Residue
A	HIS262
A	VAL263
A	GLN264
A	HIS265

---

site_id	CC2
Number of Residues	7
Details	BINDING SITE FOR RESIDUE EDO A 1367

Chain	Residue
A	ASP247
A	ASN249
A	TRP251
A	GLN256
A	EDO1362
A	HOH2178
A	HOH2257

---

site_id	CC3
Number of Residues	8
Details	BINDING SITE FOR RESIDUE EDO A 1368

Chain	Residue
A	ARG12
A	THR21
A	LYS117
A	MET120
A	ASP121
A	ASP145
A	HOH2002
A	HOH2107

---

site_id	CC4
Number of Residues	4
Details	BINDING SITE FOR RESIDUE EDO A 1369

Chain	Residue
A	HOH2100
A	TYR92
A	ARG94
A	HOH2096

---

site_id	CC5
Number of Residues	3
Details	BINDING SITE FOR RESIDUE EDO A 1370

Chain	Residue
A	ARG95
A	VAL96
A	ASN171

---

site_id	CC6
Number of Residues	5
Details	BINDING SITE FOR RESIDUE EDO A 1371

Chain	Residue
A	ASN313
A	ASN315
A	GLN317
A	HOH2210
A	HOH2237

---

site_id	CC7
Number of Residues	3
Details	BINDING SITE FOR RESIDUE EDO A 1372

Chain	Residue
A	LYS167
A	ASP204
A	HOH2139

---

site_id	CC8
Number of Residues	3
Details	BINDING SITE FOR RESIDUE EDO A 1373

Chain	Residue
A	ASP210
A	LYS212
A	EDO1377

---

site_id	CC9
Number of Residues	5
Details	BINDING SITE FOR RESIDUE EDO A 1374

Chain	Residue
A	LEU47
A	GLN48
A	GLN321
A	HOH2022
A	HOH2236

---

site_id	DC1
Number of Residues	4
Details	BINDING SITE FOR RESIDUE EDO A 1375

Chain	Residue
A	LYS309
A	THR318
A	PHE320
A	HOH2235

---

site_id	DC2
Number of Residues	3
Details	BINDING SITE FOR RESIDUE EDO A 1376

Chain	Residue
A	ASN308
A	ASP310
A	EDO1353

---

site_id	DC3
Number of Residues	4
Details	BINDING SITE FOR RESIDUE EDO A 1377

Chain	Residue
A	LYS36
A	GLN37
A	EDO1373
A	HOH2125

---

Functional Information from SwissProt/UniProt

site_id	SWS_FT_FI1
Number of Residues	33
Details	Repeat: {"description":"ANK 1"}

Chain

Residue

Details

---

site_id	SWS_FT_FI2
Number of Residues	32
Details	Repeat: {"description":"ANK 2"}

Chain

Residue

Details

---

site_id	SWS_FT_FI3
Number of Residues	30
Details	Repeat: {"description":"ANK 3"}

Chain

Residue

Details

---

site_id	SWS_FT_FI4
Number of Residues	29
Details	Repeat: {"description":"ANK 4"}

Chain

Residue

Details

---

site_id	SWS_FT_FI5
Number of Residues	29
Details	Repeat: {"description":"ANK 5"}

Chain

Residue

Details

---

site_id	SWS_FT_FI6
Number of Residues	30
Details	Repeat: {"description":"ANK 6"}

Chain

Residue

Details

---

site_id	SWS_FT_FI7
Number of Residues	1
Details	Modified residue: {"description":"Phosphotyrosine","evidences":[{"source":"UniProtKB","id":"Q4ACU6","evidenceCode":"ECO:0000250"}]}

Chain

Residue

Details

---