Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "13c830babcb49fd9933f48604eb44034",
"space_group_name": "I 21 21 21",
"unit_cell": {
"a": 107.71,
"b": 129.76,
"c": 298.69,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.91162,0.97961,0.97975],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [29.748,2.15],
"number_observations_unique": 111860,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.073
},
{
"type": "I/SigI",
"value": 8.940
},
{
"type": "Completeness",
"value": 97.100
}
]
},
"refln_shells": [
{
"resolution_limits": [2.23,2.15],
"number_observations": 40676,
"number_observations_unique": 21162,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.657
},
{
"type": "I/SigI",
"value": 1.2
},
{
"type": "Completeness",
"value": 92.50
}
]
},
{
"resolution_limits": [2.32,2.23],
"number_observations": 42382,
"number_observations_unique": 21866,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.547
},
{
"type": "I/SigI",
"value": 1.5
},
{
"type": "Completeness",
"value": 98.90
}
]
},
{
"resolution_limits": [2.42,2.32],
"number_observations": 40225,
"number_observations_unique": 20646,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.432
},
{
"type": "I/SigI",
"value": 1.9
},
{
"type": "Completeness",
"value": 99.00
}
]
},
{
"resolution_limits": [2.55,2.42],
"number_observations": 43228,
"number_observations_unique": 22103,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.312
},
{
"type": "I/SigI",
"value": 2.6
},
{
"type": "Completeness",
"value": 98.60
}
]
},
{
"resolution_limits": [2.71,2.55],
"number_observations": 42550,
"number_observations_unique": 21676,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.227
},
{
"type": "I/SigI",
"value": 3.7
},
{
"type": "Completeness",
"value": 98.40
}
]
},
{
"resolution_limits": [2.92,2.71],
"number_observations": 42826,
"number_observations_unique": 21685,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.164
},
{
"type": "I/SigI",
"value": 5.0
},
{
"type": "Completeness",
"value": 98.20
}
]
},
{
"resolution_limits": [3.21,2.92],
"number_observations": 42128,
"number_observations_unique": 21249,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.102
},
{
"type": "I/SigI",
"value": 8.0
},
{
"type": "Completeness",
"value": 97.80
}
]
},
{
"resolution_limits": [3.67,3.21],
"number_observations": 42634,
"number_observations_unique": 21343,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.055
},
{
"type": "I/SigI",
"value": 13.9
},
{
"type": "Completeness",
"value": 97.30
}
]
},
{
"resolution_limits": [4.61,3.67],
"number_observations": 42769,
"number_observations_unique": 21196,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.032
},
{
"type": "I/SigI",
"value": 22.9
},
{
"type": "Completeness",
"value": 96.50
}
]
},
{
"resolution_limits": [29.748,4.61],
"number_observations": 43233,
"number_observations_unique": 21163,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.024
},
{
"type": "I/SigI",
"value": 29.1
},
{
"type": "Completeness",
"value": 94.60
}
]
}
]
}