2O5Z

Crystal structure of the 1E9 LeuH47Trp/ArgH100Trp Fab 5-beta-androstane-3,17-dione complex

Functional Information from PDB Data

site_id	AC1
Number of Residues	4
Details	BINDING SITE FOR RESIDUE SO4 L 302

Chain	Residue
L	PRO8
L	LEU9
L	SER10
L	SER156

---

site_id	AC2
Number of Residues	2
Details	BINDING SITE FOR RESIDUE SO4 L 304

Chain	Residue
L	GLN27
L	SER27

---

site_id	AC3
Number of Residues	5
Details	BINDING SITE FOR RESIDUE SO4 L 305

Chain	Residue
L	ASP60
L	LYS188
L	SER52
L	ASN53
L	ARG54

---

site_id	AC4
Number of Residues	2
Details	BINDING SITE FOR RESIDUE SO4 L 308

Chain	Residue
L	HIS93
L	PHE94

---

site_id	AC5
Number of Residues	4
Details	BINDING SITE FOR RESIDUE SO4 L 311

Chain	Residue
H	LYS13
H	SER115
H	HOH360
L	SER202

---

site_id	AC6
Number of Residues	3
Details	BINDING SITE FOR RESIDUE SO4 L 312

Chain	Residue
L	PRO59
L	ARG61
L	GLU81

---

site_id	AC7
Number of Residues	7
Details	BINDING SITE FOR RESIDUE SO4 L 314

Chain	Residue
H	GLN105
L	GLN42
L	SER43
L	LYS45
L	HOH390
L	HOH401
L	HOH402

---

site_id	AC8
Number of Residues	3
Details	BINDING SITE FOR RESIDUE SO4 L 316

Chain	Residue
H	GLU56
H	SER57
L	ARG211

---

site_id	AC9
Number of Residues	6
Details	BINDING SITE FOR RESIDUE SO4 L 319

Chain	Residue
H	GLY169
H	HIS172
H	SO4317
L	ASN138
L	ASP170
L	HOH350

---

site_id	BC1
Number of Residues	4
Details	BINDING SITE FOR RESIDUE SO4 L 322

Chain	Residue
L	SER114
L	ASN138
L	HOH327
L	HOH407

---

site_id	BC2
Number of Residues	7
Details	BINDING SITE FOR RESIDUE SO4 H 301

Chain	Residue
H	TYR27
H	TYR27
H	MET28
H	MET28
H	TYR32
H	TYR32
H	HOH337

---

site_id	BC3
Number of Residues	4
Details	BINDING SITE FOR RESIDUE SO4 H 303

Chain	Residue
H	GLN179
H	SER180
H	HOH357
L	GLN160

---

site_id	BC4
Number of Residues	5
Details	BINDING SITE FOR RESIDUE SO4 H 306

Chain	Residue
H	VAL2
H	MET28
H	ASN31
H	ARG94
H	TYR102

---

site_id	BC5
Number of Residues	8
Details	BINDING SITE FOR RESIDUE SO4 H 307

Chain	Residue
H	ASN84
H	SER112
H	SER113
H	HOH327
H	HOH344
H	HOH398
L	ARG108
L	ALA111

---

site_id	BC6
Number of Residues	3
Details	BINDING SITE FOR RESIDUE SO4 H 309

Chain	Residue
H	ASP220
H	LYS221
H	LYS222

---

site_id	BC7
Number of Residues	1
Details	BINDING SITE FOR RESIDUE SO4 H 310

Chain	Residue
H	GLY118

---

site_id	BC8
Number of Residues	2
Details	BINDING SITE FOR RESIDUE SO4 H 313

Chain	Residue
H	GLU16
H	THR17

---

site_id	BC9
Number of Residues	3
Details	BINDING SITE FOR RESIDUE SO4 H 315

Chain	Residue
H	ARG66
H	LYS83
H	GLU85

---

site_id	CC1
Number of Residues	6
Details	BINDING SITE FOR RESIDUE SO4 H 317

Chain	Residue
H	SER168
H	GLY169
H	HOH380
H	HOH410
L	LYS169
L	SO4319

---

site_id	CC2
Number of Residues	4
Details	BINDING SITE FOR RESIDUE SO4 H 318

Chain	Residue
H	LYS83
H	ASN84
H	GLU85
H	HOH373

---

site_id	CC3
Number of Residues	2
Details	BINDING SITE FOR RESIDUE SO4 H 320

Chain	Residue
H	GLN81
L	ASN210

---

site_id	CC4
Number of Residues	3
Details	BINDING SITE FOR RESIDUE SO4 H 321

Chain	Residue
H	GLU72
H	THR73
H	SER74

---

site_id	CC5
Number of Residues	4
Details	BINDING SITE FOR RESIDUE SO4 H 323

Chain	Residue
H	SER7
H	GLY8
H	LYS213
H	HOH394

---

site_id	CC6
Number of Residues	6
Details	BINDING SITE FOR RESIDUE ANO H 501

Chain	Residue
H	ASN35
H	TRP50
H	GLY95
H	TRP100
L	ASN28
L	SER91

---

Functional Information from PROSITE/UniProt

site_id	PS00290
Number of Residues	7
Details	IG_MHC Immunoglobulins and major histocompatibility complex proteins signature. YACEVTH

Chain	Residue	Details
L	TYR192-HIS198
H	TYR206-HIS212

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