Binding Site Information of Target

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Target General Information
Drug Binding Sites of Target
References
Target General Information  Top
Target ID T59230 Target Info
Target Name Estradiol 17 beta-dehydrogenase 4 (HSD17B4)
Synonyms MFE-2; HSD17B4; DBP; D-bifunctional protein; 17-beta-hydroxysteroid dehydrogenase 4; 17-beta-HSD 4; 17 beta-hydroxysteroid dehydrogenase type 4
Target Type Literature-reported Target
Gene Name HSD17B4
Biochemical Class Short-chain dehydrogenases reductase
UniProt ID
DHB4_HUMAN
Drug Binding Sites of Target  Top
Ligand Name: Nicotinamide-Adenine-Dinucleotide Ligand Info
Structure Description Crystal Structure Of Human 17-Beta-Hydroxysteroid Dehydrogenase Type 4 In Complex With NAD PDB:1ZBQ
Method X-ray diffraction Resolution 2.19 Å Mutation No [1]
PDB Sequence
SPLRFDGRVV
12
LVTGAGAGLG
22
RAYALAFAER
32
GALVVVNDLG
42
GDFKGVGKGS
52

LAADKVVEEI
62
RRRGGKAVAN
72
YDSVEEGEKV
82
VKTALDAFGR
92
IDVVVNNAGI
102

LRDRSFARIS
112
DEDWDIIHRV
122
HLRGSFQVTR
132
AAWEHMKKQK
142
YGRIIMTSSA
152

SGIYGNFGQA
162
NYSAAKLGLL
172
GLANSLAIEG
182
RKSNIHCNTI
192
APNAGSRMTQ
202

TVMPEDLVEA
212
LKPEYVAPLV
222
LWLCHESCEE
232
NGGLFEVGAG
242
WIGKLRWERT
252

LGAIVRQKNH
262
PMTPEAVKAN
272
WKKICDFENA
282
SKPQSIQEST
292
GSIIEVLSKI
302

DS
Residue
Distance (Å)
THR15
4.955
GLY16
3.403
ALA17
4.987
GLY18
4.070
ALA19
3.589
GLY20
3.469
LEU21
2.861
GLY22
4.436
ASN39
3.288
ASP40
2.406
LEU41
3.494
GLY42
4.023
GLY43
3.897
PHE45
4.255
ASP74
4.032
SER75
2.730
VAL76
3.158
GLU77
4.417
ASN99
2.878
Residue
Distance (Å)
ALA100
3.464
GLY101
3.370
ILE102
3.577
VAL122
3.857
HIS123
3.487
THR149
3.501
SER150
3.414
SER151
3.469
ALA152
4.955
TYR164
2.590
LYS168
2.868
PRO194
2.983
ASN195
3.297
ALA196
2.896
GLY197
4.998
SER198
2.458
ARG199
2.776
MET200
3.388
THR201
4.418
Ligand Name: Oxtoxynol-10 Ligand Info
Structure Description LIGANDED STEROL CARRIER PROTEIN TYPE 2 (SCP-2) LIKE DOMAIN OF HUMAN MULTIFUNCTIONAL ENZYME TYPE 2 (MFE-2) PDB:1IKT
Method X-ray diffraction Resolution 1.75 Å Mutation No [2]
PDB Sequence
LQSTFVFEEI
15
GRRLKDIGPE
25
VVKKVNAVFE
35
WHITKGGNIG
45
AKWTIDLKSG
55

SGKVYQGPAK
65
GAADTTIILS
75
DEDFMEVVLG
85
KLDPQKAFFS
95
GRLKARGNIM
105

LSQKLQMILK
115
DYAKL
Residue
Distance (Å)
ILE15
4.244
TRP36
3.609
ILE50
4.582
PHE79
3.714
VAL82
3.763
VAL83
3.850
PRO89
3.683
GLN90
3.113
PHE93
3.569
PHE94
3.932
Residue
Distance (Å)
LEU98
4.053
ALA100
4.707
ILE104
4.252
MET105
3.537
SER107
3.205
GLN108
2.954
LEU110
4.207
GLN111
3.181
LEU114
3.675
LYS115
3.990
Click to View More Binding Site Information of This Target and Ligand Pair
References  Top
REF 1 Crystal Structure Of Human 17-Beta-Hydroxysteroid Dehydrogenase Type 4 In Complex With NAD
REF 2 Crystal structure of the liganded SCP-2-like domain of human peroxisomal multifunctional enzyme type 2 at 1.75 A resolution. J Mol Biol. 2001 Nov 9;313(5):1127-38.

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